Input buildinfo: https://buildinfos.debian.net/buildinfo-pool/c/chemps2/chemps2_1.8.10-2_amd64.buildinfo Use metasnap for getting required timestamps New buildinfo file: /tmp/chemps2-1.8.10-2em2paxw6/chemps2_1.8.10-2_amd64.buildinfo Get source package info: chemps2=1.8.10-2 Source URL: http://snapshot.notset.fr/mr/package/chemps2/1.8.10-2/srcfiles?fileinfo=1 env -i PATH=/usr/sbin:/usr/bin:/sbin:/bin TMPDIR=/tmp mmdebstrap --arch=amd64 --include=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 binutils=2.35.1-7 binutils-common=2.35.1-7 binutils-x86-64-linux-gnu=2.35.1-7 bsdextrautils=2.36.1-7 bsdutils=1:2.36.1-7 build-essential=12.9 bzip2=1.0.8-4 cmake=3.18.4-2 cmake-data=3.18.4-2 coreutils=8.32-4+b1 cpp=4:10.2.1-1 cpp-10=10.2.1-6 cython3=0.29.21-3+b1 dash=0.5.11+git20200708+dd9ef66-5 debconf=1.5.74 debhelper=13.3.3 debianutils=4.11.2 dh-autoreconf=20 dh-python=4.20201102 dh-strip-nondeterminism=1.11.0-1 diffutils=1:3.7-5 docutils-common=0.16+dfsg-3 dpkg=1.20.7.1 dpkg-dev=1.20.7.1 dwz=0.13+20210201-1 file=1:5.39-3 findutils=4.8.0-1 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 grep=3.6-1 groff-base=1.22.4-6 gzip=1.10-2 hdf5-helpers=1.10.6+repack-2 hostname=3.23 init-system-helpers=1.60 intltool-debian=0.35.0+20060710.5 libacl1=2.2.53-10 libaec-dev=1.0.4-1 libaec0=1.0.4-1 libarchive-zip-perl=1.68-1 libarchive13=3.4.3-2 libasan6=10.2.1-6 libatomic1=10.2.1-6 libattr1=1:2.4.48-6 libaudit-common=1:3.0-2 libaudit1=1:3.0-2 libbinutils=2.35.1-7 libblas-dev=3.9.0-3 libblas3=3.9.0-3 libblkid1=2.36.1-7 libbrotli1=1.0.9-2+b2 libbz2-1.0=1.0.8-4 libc-bin=2.31-9 libc-dev-bin=2.31-9 libc6=2.31-9 libc6-dev=2.31-9 libcap-ng0=0.7.9-2.2+b1 libcc1-0=10.2.1-6 libcom-err2=1.46.1-1 libcrypt-dev=1:4.4.17-1 libcrypt1=1:4.4.17-1 libctf-nobfd0=2.35.1-7 libctf0=2.35.1-7 libcurl4=7.74.0-1.1 libdb5.3=5.3.28+dfsg1-0.8 libdebconfclient0=0.256 libdebhelper-perl=13.3.3 libdpkg-perl=1.20.7.1 libelf1=0.183-1 libexpat1=2.2.10-1 libexpat1-dev=2.2.10-1 libffi7=3.3-5 libfile-stripnondeterminism-perl=1.11.0-1 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 libgfortran5=10.2.1-6 libgmp10=2:6.2.1+dfsg-1 libgnutls30=3.7.0-7 libgomp1=10.2.1-6 libgpg-error0=1.38-2 libgssapi-krb5-2=1.18.3-4 libhdf5-103-1=1.10.6+repack-2 libhdf5-cpp-103-1=1.10.6+repack-2 libhdf5-dev=1.10.6+repack-2 libhdf5-fortran-102=1.10.6+repack-2 libhdf5-hl-100=1.10.6+repack-2 libhdf5-hl-cpp-100=1.10.6+repack-2 libhdf5-hl-fortran-100=1.10.6+repack-2 libhogweed6=3.7-2 libicu67=67.1-6 libidn2-0=2.3.0-5 libisl23=0.23-1 libitm1=10.2.1-6 libjpeg-dev=1:2.0.6-1 libjpeg62-turbo=1:2.0.6-1 libjpeg62-turbo-dev=1:2.0.6-1 libjsoncpp24=1.9.4-4 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 libldap-2.4-2=2.4.57+dfsg-2 liblsan0=10.2.1-6 liblz4-1=1.9.3-1 liblzma5=5.2.5-1.0 libmagic-mgc=1:5.39-3 libmagic1=1:5.39-3 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 libnghttp2-14=1.43.0-1 libnsl-dev=1.3.0-2 libnsl2=1.3.0-2 libp11-kit0=0.23.22-1 libpam-modules=1.4.0-4 libpam-modules-bin=1.4.0-4 libpam-runtime=1.4.0-4 libpam0g=1.4.0-4 libpcre2-8-0=10.36-2 libpcre3=2:8.39-13 libperl5.32=5.32.1-2 libpipeline1=1.5.3-1 libprocps8=2:3.3.17-4 libpsl5=0.21.0-1.2 libpython3-dev=3.9.1-1 libpython3-stdlib=3.9.1-1 libpython3.9=3.9.1-4 libpython3.9-dev=3.9.1-4 libpython3.9-minimal=3.9.1-4 libpython3.9-stdlib=3.9.1-4 libquadmath0=10.2.1-6 libreadline8=8.1-1 librhash0=1.4.1-1 librtmp1=2.4+20151223.gitfa8646d.1-2+b2 libsasl2-2=2.1.27+dfsg-2.1 libsasl2-modules-db=2.1.27+dfsg-2.1 libseccomp2=2.5.1-1 libselinux1=3.1-3 libsigsegv2=2.13-1 libsmartcols1=2.36.1-7 libsqlite3-0=3.34.1-2 libssh2-1=1.9.0-2 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 libsystemd0=247.3-1 libsz2=1.0.4-1 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 libudev1=247.3-1 libunistring2=0.9.10-4 libuuid1=2.36.1-7 libuv1=1.40.0-1 libxml2=2.9.10+dfsg-6.3+b1 libzstd1=1.4.8+dfsg-1 linux-libc-dev=5.10.13-1 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 ncurses-base=6.2+20201114-2 ncurses-bin=6.2+20201114-2 patch=2.7.6-7 perl=5.32.1-2 perl-base=5.32.1-2 perl-modules-5.32=5.32.1-2 po-debconf=1.0.21+nmu1 procps=2:3.3.17-4 python3=3.9.1-1 python3-all=3.9.1-1 python3-distutils=3.9.2-1 python3-docutils=0.16+dfsg-3 python3-lib2to3=3.9.2-1 python3-minimal=3.9.1-1 python3-numpy=1:1.19.5-1 python3-pkg-resources=52.0.0-1 python3-roman=2.0.0-5 python3-setuptools=52.0.0-1 python3.9=3.9.1-4 python3.9-minimal=3.9.1-4 readline-common=8.1-1 sed=4.7-1 sensible-utils=0.0.14 sgml-base=1.30 sysvinit-utils=2.96-5 tar=1.34+dfsg-1 tzdata=2021a-1 util-linux=2.36.1-7 xml-core=0.18+nmu1 xz-utils=5.2.5-1.0 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/20210902T205533Z/ unstable main deb http://snapshot.notset.fr/archive/debian/20210218T111050Z/ 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 chemps2=1.8.10-2 && mkdir -p /build/chemps2-kynhKE && dpkg-source --no-check -x /*.dsc /build/chemps2-kynhKE/chemps2-1.8.10 && chown -R builduser:builduser /build/chemps2-kynhKE" --customize-hook=chroot "$1" env --unset=TMPDIR runuser builduser -c "cd /build/chemps2-kynhKE/chemps2-1.8.10 && env DEB_BUILD_OPTIONS="parallel=4" LC_ALL="C.UTF-8" SOURCE_DATE_EPOCH="1613980992" dpkg-buildpackage -uc -a amd64 --build=any" --customize-hook=sync-out /build/chemps2-kynhKE /tmp/chemps2-1.8.10-2em2paxw6 bullseye /dev/null deb http://snapshot.notset.fr/archive/debian/20210218T111050Z 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.O3ldCIq2IX 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.O3ldCIq2IX 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/20210218T111050Z unstable/main amd64 libfakeroot amd64 1.25.3-1.1 [47.0 kB] Get:2 http://snapshot.notset.fr/archive/debian/20210218T111050Z 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 (1126 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 ... 4662 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 (2.31-9) ... 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/20210902T205533Z/ unstable main deb http://snapshot.notset.fr/archive/debian/20210218T111050Z/ unstable main' >> /etc/apt/sources.list && apt-get update"' exec /tmp/mmdebstrap.O3ldCIq2IX Get:1 http://snapshot.notset.fr/archive/debian/20210814T212851Z bookworm InRelease [81.6 kB] Get:2 http://snapshot.notset.fr/archive/debian/20210902T205533Z unstable InRelease [165 kB] Hit:3 http://snapshot.notset.fr/archive/debian/20210218T111050Z unstable InRelease Ign:4 http://snapshot.notset.fr/archive/debian/20210814T212851Z bookworm/main Sources Ign:5 http://snapshot.notset.fr/archive/debian/20210814T212851Z bookworm/main amd64 Packages Ign:4 http://snapshot.notset.fr/archive/debian/20210814T212851Z bookworm/main Sources Ign:5 http://snapshot.notset.fr/archive/debian/20210814T212851Z bookworm/main amd64 Packages Ign:4 http://snapshot.notset.fr/archive/debian/20210814T212851Z bookworm/main Sources Ign:5 http://snapshot.notset.fr/archive/debian/20210814T212851Z bookworm/main amd64 Packages Get:4 http://snapshot.notset.fr/archive/debian/20210814T212851Z bookworm/main Sources [11.4 MB] Get:5 http://snapshot.notset.fr/archive/debian/20210814T212851Z bookworm/main amd64 Packages [11.1 MB] Ign:6 http://snapshot.notset.fr/archive/debian/20210902T205533Z unstable/main amd64 Packages Ign:6 http://snapshot.notset.fr/archive/debian/20210902T205533Z unstable/main amd64 Packages Ign:6 http://snapshot.notset.fr/archive/debian/20210902T205533Z unstable/main amd64 Packages Get:6 http://snapshot.notset.fr/archive/debian/20210902T205533Z unstable/main amd64 Packages [11.9 MB] Fetched 34.6 MB in 30s (1141 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.O3ldCIq2IX I: running --customize-hook in shell: sh -c 'chroot "$1" env sh -c "apt-get source --only-source -d chemps2=1.8.10-2 && mkdir -p /build/chemps2-kynhKE && dpkg-source --no-check -x /*.dsc /build/chemps2-kynhKE/chemps2-1.8.10 && chown -R builduser:builduser /build/chemps2-kynhKE"' exec /tmp/mmdebstrap.O3ldCIq2IX Reading package lists... NOTICE: 'chemps2' packaging is maintained in the 'Git' version control system at: https://salsa.debian.org/debichem-team/chemps2.git Please use: git clone https://salsa.debian.org/debichem-team/chemps2.git to retrieve the latest (possibly unreleased) updates to the package. Need to get 1267 kB of source archives. Get:1 http://snapshot.notset.fr/archive/debian/20210814T212851Z bookworm/main chemps2 1.8.10-2 (dsc) [2564 B] Get:2 http://snapshot.notset.fr/archive/debian/20210814T212851Z bookworm/main chemps2 1.8.10-2 (tar) [1250 kB] Get:3 http://snapshot.notset.fr/archive/debian/20210814T212851Z bookworm/main chemps2 1.8.10-2 (diff) [14.6 kB] Fetched 1267 kB in 1s (1094 kB/s) Download complete and in download only mode W: Download is performed unsandboxed as root as file 'chemps2_1.8.10-2.dsc' couldn't be accessed by user '_apt'. - pkgAcquire::Run (13: Permission denied) dpkg-source: info: extracting chemps2 in /build/chemps2-kynhKE/chemps2-1.8.10 dpkg-source: info: unpacking chemps2_1.8.10.orig.tar.gz dpkg-source: info: unpacking chemps2_1.8.10-2.debian.tar.xz I: running --customize-hook in shell: sh -c 'chroot "$1" env --unset=TMPDIR runuser builduser -c "cd /build/chemps2-kynhKE/chemps2-1.8.10 && env DEB_BUILD_OPTIONS="parallel=4" LC_ALL="C.UTF-8" SOURCE_DATE_EPOCH="1613980992" dpkg-buildpackage -uc -a amd64 --build=any"' exec /tmp/mmdebstrap.O3ldCIq2IX dpkg-buildpackage: info: source package chemps2 dpkg-buildpackage: info: source version 1.8.10-2 dpkg-buildpackage: info: source distribution unstable dpkg-buildpackage: info: source changed by Michael Banck dpkg-source --before-build . dpkg-buildpackage: info: host architecture amd64 fakeroot debian/rules clean dh clean --with python3 debian/rules override_dh_clean make[1]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10' dh_clean rm -rf build-sphinx PyCheMPS2/build PyCheMPS2/PyCheMPS2.cpp PyCheMPS2/*.pyc make[1]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10' debian/rules build-arch dh build-arch --with python3 dh_update_autotools_config -a dh_autoreconf -a debian/rules override_dh_auto_configure make[1]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10' dh_auto_configure -- -DCMAKE_INSTALL_LIBDIR=lib/x86_64-linux-gnu \ -DENABLE_XHOST=OFF \ -DBUILD_SPHINX=OFF \ -DHDF5_INCLUDE_DIRS=/usr/include/hdf5/serial \ -DCMAKE_BUILD_TYPE=release cd obj-x86_64-linux-gnu && cmake -DCMAKE_INSTALL_PREFIX=/usr -DCMAKE_BUILD_TYPE=None -DCMAKE_INSTALL_SYSCONFDIR=/etc -DCMAKE_INSTALL_LOCALSTATEDIR=/var -DCMAKE_EXPORT_NO_PACKAGE_REGISTRY=ON -DCMAKE_FIND_PACKAGE_NO_PACKAGE_REGISTRY=ON -DCMAKE_INSTALL_RUNSTATEDIR=/run "-GUnix Makefiles" -DCMAKE_VERBOSE_MAKEFILE=ON -DCMAKE_INSTALL_LIBDIR=lib/x86_64-linux-gnu -DCMAKE_INSTALL_LIBDIR=lib/x86_64-linux-gnu -DENABLE_XHOST=OFF -DBUILD_SPHINX=OFF -DHDF5_INCLUDE_DIRS=/usr/include/hdf5/serial -DCMAKE_BUILD_TYPE=release .. -- The C compiler identification is GNU 10.2.1 -- The CXX compiler identification is GNU 10.2.1 -- Detecting C compiler ABI info -- Detecting C compiler ABI info - done -- Check for working C compiler: /usr/bin/cc - skipped -- Detecting C compile features -- Detecting C compile features - done -- Detecting CXX compiler ABI info -- Detecting CXX compiler ABI info - done -- Check for working CXX compiler: /usr/bin/c++ - skipped -- Detecting CXX compile features -- Detecting CXX compile features - done -- The CMake build type is release -- Found OpenMP_C: -fopenmp (found version "4.5") -- Found OpenMP_CXX: -fopenmp (found version "4.5") -- Found OpenMP: TRUE (found version "4.5") -- Performing Test HAS_IPO -- Performing Test HAS_IPO - Failed -- Performing Test HAS_FLTO -- Performing Test HAS_FLTO - Success -- Looking for sgemm_ -- Looking for sgemm_ - not found -- Looking for pthread.h -- Looking for pthread.h - found -- Performing Test CMAKE_HAVE_LIBC_PTHREAD -- Performing Test CMAKE_HAVE_LIBC_PTHREAD - Success -- Found Threads: TRUE -- Looking for sgemm_ -- Looking for sgemm_ - found -- Found BLAS: /usr/lib/x86_64-linux-gnu/libblas.so -- LAPACK detected. -- Found TargetLAPACK: Found LAPACK: /usr/lib/x86_64-linux-gnu/liblapack.so;/usr/lib/x86_64-linux-gnu/libblas.so -- HDF5 detected. -- Found TargetHDF5: Found HDF5: /usr/lib/x86_64-linux-gnu/hdf5/serial/libhdf5.so;/usr/lib/x86_64-linux-gnu/libpthread.so;/usr/lib/x86_64-linux-gnu/libsz.so;/usr/lib/x86_64-linux-gnu/libz.so;/usr/lib/x86_64-linux-gnu/libdl.so;/usr/lib/x86_64-linux-gnu/libm.so (found version 1.10.6) (found version "1.10.6") -- Configuring done -- Generating done CMake Warning: Manually-specified variables were not used by the project: CMAKE_EXPORT_NO_PACKAGE_REGISTRY -- Build files have been written to: /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu make[1]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10' debian/rules override_dh_auto_build make[1]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10' dh_auto_build -- VERBOSE=1 cd obj-x86_64-linux-gnu && make -j4 "INSTALL=install --strip-program=true" VERBOSE=1 VERBOSE=1 make[2]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' /usr/bin/cmake -S/build/chemps2-kynhKE/chemps2-1.8.10 -B/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu --check-build-system CMakeFiles/Makefile.cmake 0 /usr/bin/cmake -E cmake_progress_start /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CMakeFiles /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu//CMakeFiles/progress.marks make -f CMakeFiles/Makefile2 all make[3]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make -f CheMPS2/CMakeFiles/chemps2-base.dir/build.make CheMPS2/CMakeFiles/chemps2-base.dir/depend make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/chemps2-kynhKE/chemps2-1.8.10 /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2 /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2/CMakeFiles/chemps2-base.dir/DependInfo.cmake --color= Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2/CMakeFiles/chemps2-base.dir/DependInfo.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2/CMakeFiles/chemps2-base.dir/depend.internal". Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2/CMakeFiles/chemps2-base.dir/depend.internal". Scanning dependencies of target chemps2-base make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make -f CheMPS2/CMakeFiles/chemps2-base.dir/build.make CheMPS2/CMakeFiles/chemps2-base.dir/build make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 1%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/CASPT2.cpp.o [ 4%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/CASSCF.cpp.o [ 4%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/CASSCFnewtonraphson.cpp.o [ 4%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/CASSCFdebug.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/CASSCFdebug.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/CASSCFdebug.cpp cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/CASPT2.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/CASPT2.cpp cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/CASSCFnewtonraphson.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/CASSCFnewtonraphson.cpp cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/CASSCF.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/CASSCF.cpp [ 5%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/CASSCFpt2.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/CASSCFpt2.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/CASSCFpt2.cpp [ 6%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/ConjugateGradient.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/ConjugateGradient.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/ConjugateGradient.cpp [ 7%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/ConvergenceScheme.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/ConvergenceScheme.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/ConvergenceScheme.cpp [ 8%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Correlations.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/Correlations.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/Correlations.cpp [ 9%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Cumulant.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/Cumulant.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/Cumulant.cpp [ 10%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Davidson.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/Davidson.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/Davidson.cpp [ 11%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DIIS.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/DIIS.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/DIIS.cpp [ 13%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRG.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/DMRG.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/DMRG.cpp [ 14%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRGfock.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/DMRGfock.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/DMRGfock.cpp [ 15%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRGmpsio.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/DMRGmpsio.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/DMRGmpsio.cpp [ 16%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRGoperators.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/DMRGoperators.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/DMRGoperators.cpp [ 17%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRGoperators3RDM.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/DMRGoperators3RDM.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/DMRGoperators3RDM.cpp [ 18%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRGSCFindices.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/DMRGSCFindices.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/DMRGSCFindices.cpp [ 19%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRGSCFintegrals.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/DMRGSCFintegrals.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/DMRGSCFintegrals.cpp [ 20%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRGSCFmatrix.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/DMRGSCFmatrix.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/DMRGSCFmatrix.cpp [ 21%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRGSCFoptions.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/DMRGSCFoptions.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/DMRGSCFoptions.cpp [ 22%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRGSCFrotations.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/DMRGSCFrotations.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/DMRGSCFrotations.cpp [ 23%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRGSCFunitary.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/DMRGSCFunitary.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/DMRGSCFunitary.cpp [ 25%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRGSCFwtilde.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/DMRGSCFwtilde.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/DMRGSCFwtilde.cpp [ 26%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRGtechnics.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/DMRGtechnics.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/DMRGtechnics.cpp [ 27%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/EdmistonRuedenberg.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/EdmistonRuedenberg.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/EdmistonRuedenberg.cpp [ 28%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Excitation.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/Excitation.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/Excitation.cpp [ 29%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/FCI.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/FCI.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/FCI.cpp [ 30%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/FourIndex.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/FourIndex.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/FourIndex.cpp [ 31%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Hamiltonian.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/Hamiltonian.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/Hamiltonian.cpp [ 32%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Heff.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/Heff.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/Heff.cpp [ 33%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/HeffDiagonal.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/HeffDiagonal.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/HeffDiagonal.cpp [ 34%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/HeffDiagrams1.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/HeffDiagrams1.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/HeffDiagrams1.cpp [ 35%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/HeffDiagrams2.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/HeffDiagrams2.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/HeffDiagrams2.cpp [ 36%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/HeffDiagrams3.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/HeffDiagrams3.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/HeffDiagrams3.cpp [ 38%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/HeffDiagrams4.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/HeffDiagrams4.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/HeffDiagrams4.cpp [ 39%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/HeffDiagrams5.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/HeffDiagrams5.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/HeffDiagrams5.cpp [ 40%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Initialize.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/Initialize.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/Initialize.cpp [ 41%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Irreps.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/Irreps.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/Irreps.cpp [ 42%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Molden.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/Molden.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/Molden.cpp [ 43%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/PrintLicense.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/PrintLicense.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/PrintLicense.cpp [ 44%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Problem.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/Problem.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/Problem.cpp [ 45%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Sobject.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/Sobject.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/Sobject.cpp [ 46%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/SyBookkeeper.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/SyBookkeeper.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/SyBookkeeper.cpp [ 47%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Tensor3RDM.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/Tensor3RDM.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/Tensor3RDM.cpp [ 48%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TensorF0.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/TensorF0.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/TensorF0.cpp [ 50%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TensorF1.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/TensorF1.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/TensorF1.cpp [ 51%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TensorGYZ.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/TensorGYZ.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/TensorGYZ.cpp [ 52%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TensorKM.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/TensorKM.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/TensorKM.cpp [ 53%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TensorL.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/TensorL.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/TensorL.cpp [ 54%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TensorO.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/TensorO.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/TensorO.cpp [ 55%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TensorOperator.cpp.o [ 56%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TensorQ.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/TensorOperator.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/TensorOperator.cpp cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/TensorQ.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/TensorQ.cpp [ 57%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TensorS0.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/TensorS0.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/TensorS0.cpp [ 58%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TensorS1.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/TensorS1.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/TensorS1.cpp [ 59%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TensorT.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/TensorT.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/TensorT.cpp [ 60%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TensorX.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/TensorX.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/TensorX.cpp [ 61%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/ThreeDM.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/ThreeDM.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/ThreeDM.cpp [ 63%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TwoDM.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/TwoDM.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/TwoDM.cpp [ 64%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TwoIndex.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/TwoIndex.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/TwoIndex.cpp [ 65%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Wigner.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -o CMakeFiles/chemps2-base.dir/Wigner.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/Wigner.cpp make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 65%] Built target chemps2-base make -f CheMPS2/CMakeFiles/chemps2-shared.dir/build.make CheMPS2/CMakeFiles/chemps2-shared.dir/depend make -f CheMPS2/CMakeFiles/chemps2-static.dir/build.make CheMPS2/CMakeFiles/chemps2-static.dir/depend make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/chemps2-kynhKE/chemps2-1.8.10 /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2 /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2/CMakeFiles/chemps2-shared.dir/DependInfo.cmake --color= make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/chemps2-kynhKE/chemps2-1.8.10 /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2 /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2/CMakeFiles/chemps2-static.dir/DependInfo.cmake --color= Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2/CMakeFiles/chemps2-shared.dir/DependInfo.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2/CMakeFiles/chemps2-shared.dir/depend.internal". Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2/CMakeFiles/chemps2-static.dir/DependInfo.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2/CMakeFiles/chemps2-static.dir/depend.internal". Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2/CMakeFiles/chemps2-static.dir/depend.internal". Scanning dependencies of target chemps2-static Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2/CMakeFiles/chemps2-shared.dir/depend.internal". make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' Scanning dependencies of target chemps2-shared make -f CheMPS2/CMakeFiles/chemps2-static.dir/build.make CheMPS2/CMakeFiles/chemps2-static.dir/build make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make -f CheMPS2/CMakeFiles/chemps2-shared.dir/build.make CheMPS2/CMakeFiles/chemps2-shared.dir/build make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 67%] Linking CXX shared library libchemps2.so [ 67%] Linking CXX static library libchemps2.a cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/cmake -P CMakeFiles/chemps2-static.dir/cmake_clean_target.cmake cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/cmake -E cmake_link_script CMakeFiles/chemps2-shared.dir/link.txt --verbose=1 /usr/bin/c++ -fPIC -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -Wl,-z,relro -Wl,-z,now -shared -Wl,-soname,libchemps2.so.3 -o libchemps2.so.3 CMakeFiles/chemps2-base.dir/CASPT2.cpp.o CMakeFiles/chemps2-base.dir/CASSCF.cpp.o CMakeFiles/chemps2-base.dir/CASSCFdebug.cpp.o CMakeFiles/chemps2-base.dir/CASSCFnewtonraphson.cpp.o CMakeFiles/chemps2-base.dir/CASSCFpt2.cpp.o CMakeFiles/chemps2-base.dir/ConjugateGradient.cpp.o CMakeFiles/chemps2-base.dir/ConvergenceScheme.cpp.o CMakeFiles/chemps2-base.dir/Correlations.cpp.o CMakeFiles/chemps2-base.dir/Cumulant.cpp.o CMakeFiles/chemps2-base.dir/Davidson.cpp.o CMakeFiles/chemps2-base.dir/DIIS.cpp.o CMakeFiles/chemps2-base.dir/DMRG.cpp.o CMakeFiles/chemps2-base.dir/DMRGfock.cpp.o CMakeFiles/chemps2-base.dir/DMRGmpsio.cpp.o CMakeFiles/chemps2-base.dir/DMRGoperators.cpp.o CMakeFiles/chemps2-base.dir/DMRGoperators3RDM.cpp.o CMakeFiles/chemps2-base.dir/DMRGSCFindices.cpp.o CMakeFiles/chemps2-base.dir/DMRGSCFintegrals.cpp.o CMakeFiles/chemps2-base.dir/DMRGSCFmatrix.cpp.o CMakeFiles/chemps2-base.dir/DMRGSCFoptions.cpp.o CMakeFiles/chemps2-base.dir/DMRGSCFrotations.cpp.o CMakeFiles/chemps2-base.dir/DMRGSCFunitary.cpp.o CMakeFiles/chemps2-base.dir/DMRGSCFwtilde.cpp.o CMakeFiles/chemps2-base.dir/DMRGtechnics.cpp.o CMakeFiles/chemps2-base.dir/EdmistonRuedenberg.cpp.o CMakeFiles/chemps2-base.dir/Excitation.cpp.o CMakeFiles/chemps2-base.dir/FCI.cpp.o CMakeFiles/chemps2-base.dir/FourIndex.cpp.o CMakeFiles/chemps2-base.dir/Hamiltonian.cpp.o CMakeFiles/chemps2-base.dir/Heff.cpp.o CMakeFiles/chemps2-base.dir/HeffDiagonal.cpp.o CMakeFiles/chemps2-base.dir/HeffDiagrams1.cpp.o CMakeFiles/chemps2-base.dir/HeffDiagrams2.cpp.o CMakeFiles/chemps2-base.dir/HeffDiagrams3.cpp.o CMakeFiles/chemps2-base.dir/HeffDiagrams4.cpp.o CMakeFiles/chemps2-base.dir/HeffDiagrams5.cpp.o CMakeFiles/chemps2-base.dir/Initialize.cpp.o CMakeFiles/chemps2-base.dir/Irreps.cpp.o CMakeFiles/chemps2-base.dir/Molden.cpp.o CMakeFiles/chemps2-base.dir/PrintLicense.cpp.o CMakeFiles/chemps2-base.dir/Problem.cpp.o CMakeFiles/chemps2-base.dir/Sobject.cpp.o CMakeFiles/chemps2-base.dir/SyBookkeeper.cpp.o CMakeFiles/chemps2-base.dir/Tensor3RDM.cpp.o CMakeFiles/chemps2-base.dir/TensorF0.cpp.o CMakeFiles/chemps2-base.dir/TensorF1.cpp.o CMakeFiles/chemps2-base.dir/TensorGYZ.cpp.o CMakeFiles/chemps2-base.dir/TensorKM.cpp.o CMakeFiles/chemps2-base.dir/TensorL.cpp.o CMakeFiles/chemps2-base.dir/TensorO.cpp.o CMakeFiles/chemps2-base.dir/TensorOperator.cpp.o CMakeFiles/chemps2-base.dir/TensorQ.cpp.o CMakeFiles/chemps2-base.dir/TensorS0.cpp.o CMakeFiles/chemps2-base.dir/TensorS1.cpp.o CMakeFiles/chemps2-base.dir/TensorT.cpp.o CMakeFiles/chemps2-base.dir/TensorX.cpp.o CMakeFiles/chemps2-base.dir/ThreeDM.cpp.o CMakeFiles/chemps2-base.dir/TwoDM.cpp.o CMakeFiles/chemps2-base.dir/TwoIndex.cpp.o CMakeFiles/chemps2-base.dir/Wigner.cpp.o -Wl,-rpath,/usr/lib/x86_64-linux-gnu/hdf5/serial: -llapack -lblas /usr/lib/x86_64-linux-gnu/hdf5/serial/libhdf5.so -lpthread -lsz -lz -ldl -lm cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/cmake -E cmake_link_script CMakeFiles/chemps2-static.dir/link.txt --verbose=1 /usr/bin/ar qc libchemps2.a CMakeFiles/chemps2-base.dir/CASPT2.cpp.o CMakeFiles/chemps2-base.dir/CASSCF.cpp.o CMakeFiles/chemps2-base.dir/CASSCFdebug.cpp.o CMakeFiles/chemps2-base.dir/CASSCFnewtonraphson.cpp.o CMakeFiles/chemps2-base.dir/CASSCFpt2.cpp.o CMakeFiles/chemps2-base.dir/ConjugateGradient.cpp.o CMakeFiles/chemps2-base.dir/ConvergenceScheme.cpp.o CMakeFiles/chemps2-base.dir/Correlations.cpp.o CMakeFiles/chemps2-base.dir/Cumulant.cpp.o CMakeFiles/chemps2-base.dir/Davidson.cpp.o CMakeFiles/chemps2-base.dir/DIIS.cpp.o CMakeFiles/chemps2-base.dir/DMRG.cpp.o CMakeFiles/chemps2-base.dir/DMRGfock.cpp.o CMakeFiles/chemps2-base.dir/DMRGmpsio.cpp.o CMakeFiles/chemps2-base.dir/DMRGoperators.cpp.o CMakeFiles/chemps2-base.dir/DMRGoperators3RDM.cpp.o CMakeFiles/chemps2-base.dir/DMRGSCFindices.cpp.o CMakeFiles/chemps2-base.dir/DMRGSCFintegrals.cpp.o CMakeFiles/chemps2-base.dir/DMRGSCFmatrix.cpp.o CMakeFiles/chemps2-base.dir/DMRGSCFoptions.cpp.o CMakeFiles/chemps2-base.dir/DMRGSCFrotations.cpp.o CMakeFiles/chemps2-base.dir/DMRGSCFunitary.cpp.o CMakeFiles/chemps2-base.dir/DMRGSCFwtilde.cpp.o CMakeFiles/chemps2-base.dir/DMRGtechnics.cpp.o CMakeFiles/chemps2-base.dir/EdmistonRuedenberg.cpp.o CMakeFiles/chemps2-base.dir/Excitation.cpp.o CMakeFiles/chemps2-base.dir/FCI.cpp.o CMakeFiles/chemps2-base.dir/FourIndex.cpp.o CMakeFiles/chemps2-base.dir/Hamiltonian.cpp.o CMakeFiles/chemps2-base.dir/Heff.cpp.o CMakeFiles/chemps2-base.dir/HeffDiagonal.cpp.o CMakeFiles/chemps2-base.dir/HeffDiagrams1.cpp.o CMakeFiles/chemps2-base.dir/HeffDiagrams2.cpp.o CMakeFiles/chemps2-base.dir/HeffDiagrams3.cpp.o CMakeFiles/chemps2-base.dir/HeffDiagrams4.cpp.o CMakeFiles/chemps2-base.dir/HeffDiagrams5.cpp.o CMakeFiles/chemps2-base.dir/Initialize.cpp.o CMakeFiles/chemps2-base.dir/Irreps.cpp.o CMakeFiles/chemps2-base.dir/Molden.cpp.o CMakeFiles/chemps2-base.dir/PrintLicense.cpp.o CMakeFiles/chemps2-base.dir/Problem.cpp.o CMakeFiles/chemps2-base.dir/Sobject.cpp.o CMakeFiles/chemps2-base.dir/SyBookkeeper.cpp.o CMakeFiles/chemps2-base.dir/Tensor3RDM.cpp.o CMakeFiles/chemps2-base.dir/TensorF0.cpp.o CMakeFiles/chemps2-base.dir/TensorF1.cpp.o CMakeFiles/chemps2-base.dir/TensorGYZ.cpp.o CMakeFiles/chemps2-base.dir/TensorKM.cpp.o CMakeFiles/chemps2-base.dir/TensorL.cpp.o CMakeFiles/chemps2-base.dir/TensorO.cpp.o CMakeFiles/chemps2-base.dir/TensorOperator.cpp.o CMakeFiles/chemps2-base.dir/TensorQ.cpp.o CMakeFiles/chemps2-base.dir/TensorS0.cpp.o CMakeFiles/chemps2-base.dir/TensorS1.cpp.o CMakeFiles/chemps2-base.dir/TensorT.cpp.o CMakeFiles/chemps2-base.dir/TensorX.cpp.o CMakeFiles/chemps2-base.dir/ThreeDM.cpp.o CMakeFiles/chemps2-base.dir/TwoDM.cpp.o CMakeFiles/chemps2-base.dir/TwoIndex.cpp.o CMakeFiles/chemps2-base.dir/Wigner.cpp.o /usr/bin/ranlib libchemps2.a make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 67%] Built target chemps2-static cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/cmake -E cmake_symlink_library libchemps2.so.3 libchemps2.so.3 libchemps2.so make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 67%] Built target chemps2-shared make -f CheMPS2/CMakeFiles/chemps2-bin.dir/build.make CheMPS2/CMakeFiles/chemps2-bin.dir/depend make -f tests/CMakeFiles/test14.dir/build.make tests/CMakeFiles/test14.dir/depend make -f tests/CMakeFiles/test1.dir/build.make tests/CMakeFiles/test1.dir/depend make -f tests/CMakeFiles/test3.dir/build.make tests/CMakeFiles/test3.dir/depend make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/chemps2-kynhKE/chemps2-1.8.10 /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2 /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2/CMakeFiles/chemps2-bin.dir/DependInfo.cmake --color= make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/chemps2-kynhKE/chemps2-1.8.10 /build/chemps2-kynhKE/chemps2-1.8.10/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test14.dir/DependInfo.cmake --color= make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/chemps2-kynhKE/chemps2-1.8.10 /build/chemps2-kynhKE/chemps2-1.8.10/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test1.dir/DependInfo.cmake --color= make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/chemps2-kynhKE/chemps2-1.8.10 /build/chemps2-kynhKE/chemps2-1.8.10/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test3.dir/DependInfo.cmake --color= Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test3.dir/DependInfo.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test3.dir/depend.internal". Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test3.dir/depend.internal". Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2/CMakeFiles/chemps2-bin.dir/DependInfo.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2/CMakeFiles/chemps2-bin.dir/depend.internal". Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2/CMakeFiles/chemps2-bin.dir/depend.internal". Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test14.dir/DependInfo.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test14.dir/depend.internal". Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test14.dir/depend.internal". Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test1.dir/DependInfo.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test1.dir/depend.internal". Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test1.dir/depend.internal". Scanning dependencies of target test3 make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' Scanning dependencies of target chemps2-bin make -f tests/CMakeFiles/test3.dir/build.make tests/CMakeFiles/test3.dir/build make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' Scanning dependencies of target test14 Scanning dependencies of target test1 make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make -f CheMPS2/CMakeFiles/chemps2-bin.dir/build.make CheMPS2/CMakeFiles/chemps2-bin.dir/build make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make -f tests/CMakeFiles/test14.dir/build.make tests/CMakeFiles/test14.dir/build make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make -f tests/CMakeFiles/test1.dir/build.make tests/CMakeFiles/test1.dir/build make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 68%] Building CXX object CheMPS2/CMakeFiles/chemps2-bin.dir/executable.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -DUSING_CheMPS2 -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -isystem /usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -o CMakeFiles/chemps2-bin.dir/executable.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/executable.cpp make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 69%] Building CXX object tests/CMakeFiles/test3.dir/tests/test3.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -DUSING_CheMPS2 -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -isystem /usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -o CMakeFiles/test3.dir/tests/test3.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/tests/test3.cpp [ 70%] Building CXX object tests/CMakeFiles/test14.dir/tests/test14.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -DUSING_CheMPS2 -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -isystem /usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -o CMakeFiles/test14.dir/tests/test14.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/tests/test14.cpp [ 71%] Building CXX object tests/CMakeFiles/test1.dir/tests/test1.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -DUSING_CheMPS2 -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -isystem /usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -o CMakeFiles/test1.dir/tests/test1.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/tests/test1.cpp [ 72%] Linking CXX executable test14 cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/cmake -E cmake_link_script CMakeFiles/test14.dir/link.txt --verbose=1 [ 73%] Linking CXX executable test3 cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/cmake -E cmake_link_script CMakeFiles/test3.dir/link.txt --verbose=1 [ 75%] Linking CXX executable test1 /usr/bin/c++ -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -Wl,-z,relro -Wl,-z,now -rdynamic CMakeFiles/test14.dir/tests/test14.cpp.o -o test14 -Wl,-rpath,/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2:/usr/lib/x86_64-linux-gnu/hdf5/serial ../CheMPS2/libchemps2.so.3 -llapack -lblas /usr/lib/x86_64-linux-gnu/hdf5/serial/libhdf5.so -lpthread -lsz -lz -ldl -lm /usr/bin/c++ -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -Wl,-z,relro -Wl,-z,now -rdynamic CMakeFiles/test3.dir/tests/test3.cpp.o -o test3 -Wl,-rpath,/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2:/usr/lib/x86_64-linux-gnu/hdf5/serial ../CheMPS2/libchemps2.so.3 -llapack -lblas /usr/lib/x86_64-linux-gnu/hdf5/serial/libhdf5.so -lpthread -lsz -lz -ldl -lm cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/cmake -E cmake_link_script CMakeFiles/test1.dir/link.txt --verbose=1 /usr/bin/c++ -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -Wl,-z,relro -Wl,-z,now -rdynamic CMakeFiles/test1.dir/tests/test1.cpp.o -o test1 -Wl,-rpath,/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2:/usr/lib/x86_64-linux-gnu/hdf5/serial ../CheMPS2/libchemps2.so.3 -llapack -lblas /usr/lib/x86_64-linux-gnu/hdf5/serial/libhdf5.so -lpthread -lsz -lz -ldl -lm make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 75%] Built target test14 make -f tests/CMakeFiles/test4.dir/build.make tests/CMakeFiles/test4.dir/depend make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/chemps2-kynhKE/chemps2-1.8.10 /build/chemps2-kynhKE/chemps2-1.8.10/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test4.dir/DependInfo.cmake --color= Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test4.dir/DependInfo.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test4.dir/depend.internal". Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test4.dir/depend.internal". [ 75%] Built target test3 make -f tests/CMakeFiles/test12.dir/build.make tests/CMakeFiles/test12.dir/depend make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/chemps2-kynhKE/chemps2-1.8.10 /build/chemps2-kynhKE/chemps2-1.8.10/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test12.dir/DependInfo.cmake --color= Scanning dependencies of target test4 make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make -f tests/CMakeFiles/test4.dir/build.make tests/CMakeFiles/test4.dir/build make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 76%] Building CXX object tests/CMakeFiles/test4.dir/tests/test4.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -DUSING_CheMPS2 -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -isystem /usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -o CMakeFiles/test4.dir/tests/test4.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/tests/test4.cpp Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test12.dir/DependInfo.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test12.dir/depend.internal". Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test12.dir/depend.internal". Scanning dependencies of target test12 make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make -f tests/CMakeFiles/test12.dir/build.make tests/CMakeFiles/test12.dir/build make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 77%] Building CXX object tests/CMakeFiles/test12.dir/tests/test12.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -DUSING_CheMPS2 -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -isystem /usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -o CMakeFiles/test12.dir/tests/test12.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/tests/test12.cpp make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 77%] Built target test1 make -f tests/CMakeFiles/test6.dir/build.make tests/CMakeFiles/test6.dir/depend make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/chemps2-kynhKE/chemps2-1.8.10 /build/chemps2-kynhKE/chemps2-1.8.10/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test6.dir/DependInfo.cmake --color= Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test6.dir/DependInfo.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test6.dir/depend.internal". Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test6.dir/depend.internal". Scanning dependencies of target test6 make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make -f tests/CMakeFiles/test6.dir/build.make tests/CMakeFiles/test6.dir/build make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 78%] Linking CXX executable chemps2 cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2 && /usr/bin/cmake -E cmake_link_script CMakeFiles/chemps2-bin.dir/link.txt --verbose=1 [ 79%] Building CXX object tests/CMakeFiles/test6.dir/tests/test6.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -DUSING_CheMPS2 -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -isystem /usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -o CMakeFiles/test6.dir/tests/test6.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/tests/test6.cpp /usr/bin/c++ -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -Wl,-z,relro -Wl,-z,now -rdynamic CMakeFiles/chemps2-bin.dir/executable.cpp.o -o chemps2 -Wl,-rpath,/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2:/usr/lib/x86_64-linux-gnu/hdf5/serial: libchemps2.so.3 -llapack -lblas /usr/lib/x86_64-linux-gnu/hdf5/serial/libhdf5.so -lpthread -lsz -lz -ldl -lm [ 80%] Linking CXX executable test12 cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/cmake -E cmake_link_script CMakeFiles/test12.dir/link.txt --verbose=1 /usr/bin/c++ -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -Wl,-z,relro -Wl,-z,now -rdynamic CMakeFiles/test12.dir/tests/test12.cpp.o -o test12 -Wl,-rpath,/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2:/usr/lib/x86_64-linux-gnu/hdf5/serial ../CheMPS2/libchemps2.so.3 -llapack -lblas /usr/lib/x86_64-linux-gnu/hdf5/serial/libhdf5.so -lpthread -lsz -lz -ldl -lm [ 81%] Linking CXX executable test4 cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/cmake -E cmake_link_script CMakeFiles/test4.dir/link.txt --verbose=1 /usr/bin/c++ -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -Wl,-z,relro -Wl,-z,now -rdynamic CMakeFiles/test4.dir/tests/test4.cpp.o -o test4 -Wl,-rpath,/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2:/usr/lib/x86_64-linux-gnu/hdf5/serial ../CheMPS2/libchemps2.so.3 -llapack -lblas /usr/lib/x86_64-linux-gnu/hdf5/serial/libhdf5.so -lpthread -lsz -lz -ldl -lm [ 82%] Linking CXX executable test6 cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/cmake -E cmake_link_script CMakeFiles/test6.dir/link.txt --verbose=1 /usr/bin/c++ -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -Wl,-z,relro -Wl,-z,now -rdynamic CMakeFiles/test6.dir/tests/test6.cpp.o -o test6 -Wl,-rpath,/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2:/usr/lib/x86_64-linux-gnu/hdf5/serial ../CheMPS2/libchemps2.so.3 -llapack -lblas /usr/lib/x86_64-linux-gnu/hdf5/serial/libhdf5.so -lpthread -lsz -lz -ldl -lm make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 82%] Built target test12 [ 82%] Built target test4 make -f tests/CMakeFiles/test2.dir/build.make tests/CMakeFiles/test2.dir/depend make -f tests/CMakeFiles/test7.dir/build.make tests/CMakeFiles/test7.dir/depend make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/chemps2-kynhKE/chemps2-1.8.10 /build/chemps2-kynhKE/chemps2-1.8.10/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test2.dir/DependInfo.cmake --color= make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/chemps2-kynhKE/chemps2-1.8.10 /build/chemps2-kynhKE/chemps2-1.8.10/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test7.dir/DependInfo.cmake --color= Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test7.dir/DependInfo.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test7.dir/depend.internal". Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test7.dir/depend.internal". Scanning dependencies of target test7 make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make -f tests/CMakeFiles/test7.dir/build.make tests/CMakeFiles/test7.dir/build make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test2.dir/DependInfo.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test2.dir/depend.internal". Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test2.dir/depend.internal". [ 83%] Building CXX object tests/CMakeFiles/test7.dir/tests/test7.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -DUSING_CheMPS2 -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -isystem /usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -o CMakeFiles/test7.dir/tests/test7.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/tests/test7.cpp Scanning dependencies of target test2 make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make -f tests/CMakeFiles/test2.dir/build.make tests/CMakeFiles/test2.dir/build make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 84%] Building CXX object tests/CMakeFiles/test2.dir/tests/test2.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -DUSING_CheMPS2 -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -isystem /usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -o CMakeFiles/test2.dir/tests/test2.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/tests/test2.cpp make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 84%] Built target test6 make -f tests/CMakeFiles/test8.dir/build.make tests/CMakeFiles/test8.dir/depend make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/chemps2-kynhKE/chemps2-1.8.10 /build/chemps2-kynhKE/chemps2-1.8.10/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test8.dir/DependInfo.cmake --color= Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test8.dir/DependInfo.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test8.dir/depend.internal". Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test8.dir/depend.internal". Scanning dependencies of target test8 make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make -f tests/CMakeFiles/test8.dir/build.make tests/CMakeFiles/test8.dir/build make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 85%] Building CXX object tests/CMakeFiles/test8.dir/tests/test8.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -DUSING_CheMPS2 -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -isystem /usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -o CMakeFiles/test8.dir/tests/test8.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/tests/test8.cpp [ 86%] Linking CXX executable test7 cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/cmake -E cmake_link_script CMakeFiles/test7.dir/link.txt --verbose=1 /usr/bin/c++ -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -Wl,-z,relro -Wl,-z,now -rdynamic CMakeFiles/test7.dir/tests/test7.cpp.o -o test7 -Wl,-rpath,/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2:/usr/lib/x86_64-linux-gnu/hdf5/serial ../CheMPS2/libchemps2.so.3 -llapack -lblas /usr/lib/x86_64-linux-gnu/hdf5/serial/libhdf5.so -lpthread -lsz -lz -ldl -lm [ 88%] Linking CXX executable test2 cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/cmake -E cmake_link_script CMakeFiles/test2.dir/link.txt --verbose=1 /usr/bin/c++ -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -Wl,-z,relro -Wl,-z,now -rdynamic CMakeFiles/test2.dir/tests/test2.cpp.o -o test2 -Wl,-rpath,/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2:/usr/lib/x86_64-linux-gnu/hdf5/serial ../CheMPS2/libchemps2.so.3 -llapack -lblas /usr/lib/x86_64-linux-gnu/hdf5/serial/libhdf5.so -lpthread -lsz -lz -ldl -lm [ 89%] Linking CXX executable test8 cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/cmake -E cmake_link_script CMakeFiles/test8.dir/link.txt --verbose=1 /usr/bin/c++ -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -Wl,-z,relro -Wl,-z,now -rdynamic CMakeFiles/test8.dir/tests/test8.cpp.o -o test8 -Wl,-rpath,/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2:/usr/lib/x86_64-linux-gnu/hdf5/serial ../CheMPS2/libchemps2.so.3 -llapack -lblas /usr/lib/x86_64-linux-gnu/hdf5/serial/libhdf5.so -lpthread -lsz -lz -ldl -lm make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 89%] Built target test2 make -f tests/CMakeFiles/test13.dir/build.make tests/CMakeFiles/test13.dir/depend make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/chemps2-kynhKE/chemps2-1.8.10 /build/chemps2-kynhKE/chemps2-1.8.10/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test13.dir/DependInfo.cmake --color= Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test13.dir/DependInfo.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test13.dir/depend.internal". Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test13.dir/depend.internal". Scanning dependencies of target test13 make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make -f tests/CMakeFiles/test13.dir/build.make tests/CMakeFiles/test13.dir/build make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 90%] Building CXX object tests/CMakeFiles/test13.dir/tests/test13.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -DUSING_CheMPS2 -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -isystem /usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -o CMakeFiles/test13.dir/tests/test13.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/tests/test13.cpp make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 90%] Built target test7 make -f tests/CMakeFiles/test5.dir/build.make tests/CMakeFiles/test5.dir/depend make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/chemps2-kynhKE/chemps2-1.8.10 /build/chemps2-kynhKE/chemps2-1.8.10/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test5.dir/DependInfo.cmake --color= Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test5.dir/DependInfo.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test5.dir/depend.internal". Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test5.dir/depend.internal". Scanning dependencies of target test5 make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make -f tests/CMakeFiles/test5.dir/build.make tests/CMakeFiles/test5.dir/build make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 91%] Building CXX object tests/CMakeFiles/test5.dir/tests/test5.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -DUSING_CheMPS2 -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -isystem /usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -o CMakeFiles/test5.dir/tests/test5.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/tests/test5.cpp make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 91%] Built target test8 make -f tests/CMakeFiles/test9.dir/build.make tests/CMakeFiles/test9.dir/depend make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/chemps2-kynhKE/chemps2-1.8.10 /build/chemps2-kynhKE/chemps2-1.8.10/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test9.dir/DependInfo.cmake --color= Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test9.dir/DependInfo.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test9.dir/depend.internal". Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test9.dir/depend.internal". Scanning dependencies of target test9 make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make -f tests/CMakeFiles/test9.dir/build.make tests/CMakeFiles/test9.dir/build make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 92%] Building CXX object tests/CMakeFiles/test9.dir/tests/test9.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -DUSING_CheMPS2 -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -isystem /usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -o CMakeFiles/test9.dir/tests/test9.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/tests/test9.cpp [ 93%] Linking CXX executable test13 cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/cmake -E cmake_link_script CMakeFiles/test13.dir/link.txt --verbose=1 /usr/bin/c++ -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -Wl,-z,relro -Wl,-z,now -rdynamic CMakeFiles/test13.dir/tests/test13.cpp.o -o test13 -Wl,-rpath,/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2:/usr/lib/x86_64-linux-gnu/hdf5/serial ../CheMPS2/libchemps2.so.3 -llapack -lblas /usr/lib/x86_64-linux-gnu/hdf5/serial/libhdf5.so -lpthread -lsz -lz -ldl -lm [ 94%] Linking CXX executable test5 cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/cmake -E cmake_link_script CMakeFiles/test5.dir/link.txt --verbose=1 /usr/bin/c++ -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -Wl,-z,relro -Wl,-z,now -rdynamic CMakeFiles/test5.dir/tests/test5.cpp.o -o test5 -Wl,-rpath,/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2:/usr/lib/x86_64-linux-gnu/hdf5/serial ../CheMPS2/libchemps2.so.3 -llapack -lblas /usr/lib/x86_64-linux-gnu/hdf5/serial/libhdf5.so -lpthread -lsz -lz -ldl -lm [ 95%] Linking CXX executable test9 cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/cmake -E cmake_link_script CMakeFiles/test9.dir/link.txt --verbose=1 /usr/bin/c++ -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -Wl,-z,relro -Wl,-z,now -rdynamic CMakeFiles/test9.dir/tests/test9.cpp.o -o test9 -Wl,-rpath,/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2:/usr/lib/x86_64-linux-gnu/hdf5/serial ../CheMPS2/libchemps2.so.3 -llapack -lblas /usr/lib/x86_64-linux-gnu/hdf5/serial/libhdf5.so -lpthread -lsz -lz -ldl -lm make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 95%] Built target test13 make -f tests/CMakeFiles/test10.dir/build.make tests/CMakeFiles/test10.dir/depend make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/chemps2-kynhKE/chemps2-1.8.10 /build/chemps2-kynhKE/chemps2-1.8.10/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test10.dir/DependInfo.cmake --color= Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test10.dir/DependInfo.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test10.dir/depend.internal". Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test10.dir/depend.internal". Scanning dependencies of target test10 make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make -f tests/CMakeFiles/test10.dir/build.make tests/CMakeFiles/test10.dir/build make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 96%] Building CXX object tests/CMakeFiles/test10.dir/tests/test10.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -DUSING_CheMPS2 -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -isystem /usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -o CMakeFiles/test10.dir/tests/test10.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/tests/test10.cpp [ 96%] Built target chemps2-bin make -f tests/CMakeFiles/test11.dir/build.make tests/CMakeFiles/test11.dir/depend make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/chemps2-kynhKE/chemps2-1.8.10 /build/chemps2-kynhKE/chemps2-1.8.10/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test11.dir/DependInfo.cmake --color= Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test11.dir/DependInfo.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test11.dir/depend.internal". Dependee "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/CMakeFiles/test11.dir/depend.internal". Scanning dependencies of target test11 make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make -f tests/CMakeFiles/test11.dir/build.make tests/CMakeFiles/test11.dir/build make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 96%] Built target test5 [ 97%] Building CXX object tests/CMakeFiles/test11.dir/tests/test11.cpp.o cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.10 (2021-02-01)\"" -DH5_USE_110_API -DUSING_CheMPS2 -I/build/chemps2-kynhKE/chemps2-1.8.10/CheMPS2/include/chemps2 -isystem /usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -o CMakeFiles/test11.dir/tests/test11.cpp.o -c /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests/tests/test11.cpp make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 97%] Built target test9 [ 98%] Linking CXX executable test10 cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/cmake -E cmake_link_script CMakeFiles/test10.dir/link.txt --verbose=1 /usr/bin/c++ -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -Wl,-z,relro -Wl,-z,now -rdynamic CMakeFiles/test10.dir/tests/test10.cpp.o -o test10 -Wl,-rpath,/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2:/usr/lib/x86_64-linux-gnu/hdf5/serial ../CheMPS2/libchemps2.so.3 -llapack -lblas /usr/lib/x86_64-linux-gnu/hdf5/serial/libhdf5.so -lpthread -lsz -lz -ldl -lm [100%] Linking CXX executable test11 cd /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/tests && /usr/bin/cmake -E cmake_link_script CMakeFiles/test11.dir/link.txt --verbose=1 /usr/bin/c++ -flto -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -Wl,-z,relro -Wl,-z,now -rdynamic CMakeFiles/test11.dir/tests/test11.cpp.o -o test11 -Wl,-rpath,/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CheMPS2:/usr/lib/x86_64-linux-gnu/hdf5/serial ../CheMPS2/libchemps2.so.3 -llapack -lblas /usr/lib/x86_64-linux-gnu/hdf5/serial/libhdf5.so -lpthread -lsz -lz -ldl -lm make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [100%] Built target test10 make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [100%] Built target test11 make[3]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' /usr/bin/cmake -E cmake_progress_start /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu/CMakeFiles 0 make[2]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' cd PyCheMPS2 && CPATH=../CheMPS2/include:/usr/include/hdf5/serial python3 setup.py build_ext -L ../obj-x86_64-linux-gnu/CheMPS2 running build_ext cythoning PyCheMPS2.pyx to PyCheMPS2.cpp /usr/lib/python3/dist-packages/Cython/Compiler/Main.py:369: FutureWarning: Cython directive 'language_level' not set, using 2 for now (Py2). This will change in a later release! File: /build/chemps2-kynhKE/chemps2-1.8.10/PyCheMPS2/PyCheMPS2.pyx tree = Parsing.p_module(s, pxd, full_module_name) building 'PyCheMPS2' extension creating build creating build/temp.linux-x86_64-3.9 x86_64-linux-gnu-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/build/python3.9-euU3fN/python3.9-3.9.1=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fPIC -I/usr/lib/python3/dist-packages/numpy/core/include -I/usr/include/python3.9 -c PyCheMPS2.cpp -o build/temp.linux-x86_64-3.9/PyCheMPS2.o In file included from /usr/lib/python3/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1822, from /usr/lib/python3/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, from /usr/lib/python3/dist-packages/numpy/core/include/numpy/arrayobject.h:4, from PyCheMPS2.cpp:624: /usr/lib/python3/dist-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 17 | #warning "Using deprecated NumPy API, disable it with " \ | ^~~~~~~ creating build/lib.linux-x86_64-3.9 x86_64-linux-gnu-g++ -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 -Wl,-z,relro -Wl,-z,now -g -O2 -ffile-prefix-map=/build/chemps2-kynhKE/chemps2-1.8.10=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 build/temp.linux-x86_64-3.9/PyCheMPS2.o -L../obj-x86_64-linux-gnu/CheMPS2 -lchemps2 -o build/lib.linux-x86_64-3.9/PyCheMPS2.cpython-39-x86_64-linux-gnu.so make[1]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10' debian/rules override_dh_auto_test make[1]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10' cd obj-x86_64-linux-gnu/ && ctest -R "^test3|^test5|^test8" Test project /build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu Start 3: test3 1/3 Test #3: test3 ............................ Passed 3288.41 sec Start 5: test5 2/3 Test #5: test5 ............................ Passed 649.11 sec Start 8: test8 3/3 Test #8: test8 ............................ Passed 3247.15 sec 100% tests passed, 0 tests failed out of 3 Total Test time (real) = 7184.69 sec cd PyCheMPS2/tests && PYTHONPATH=../.././PyCheMPS2/build/lib.linux-x86_64-3.9:.. \ LD_LIBRARY_PATH=../../obj-x86_64-linux-gnu/CheMPS2:/usr/lib/x86_64-linux-gnu/hdf5/serial \ python3 test1.py CheMPS2::Hamiltonian : Reading FCIDUMP file ../../tests/matrixelements/N2.STO3G.FCIDUMP CheMPS2::Hamiltonian : Finished reading FCIDUMP file ../../tests/matrixelements/N2.STO3G.FCIDUMP CheMPS2: a spin-adapted implementation of DMRG for ab initio quantum chemistry Copyright (C) 2013-2021 Sebastian Wouters This program is free software; you can redistribute it and/or modify it under the terms of the GNU General Public License as published by the Free Software Foundation; either version 2 of the License, or (at your option) any later version. This program is distributed in the hope that it will be useful, but WITHOUT ANY WARRANTY; without even the implied warranty of MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU General Public License for more details. You should have received a copy of the GNU General Public License along with this program; if not, write to the Free Software Foundation, Inc., 51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA. Stats: nIt(DAVIDSON) = 11 Energy at sites (8, 9) is -102.841149288518 Stats: nIt(DAVIDSON) = 24 Energy at sites (7, 8) is -106.85200713738 Stats: nIt(DAVIDSON) = 59 Energy at sites (6, 7) is -106.889168658829 Stats: nIt(DAVIDSON) = 73 Energy at sites (5, 6) is -106.909579432799 Stats: nIt(DAVIDSON) = 40 Energy at sites (4, 5) is -107.639482155242 Stats: nIt(DAVIDSON) = 27 Energy at sites (3, 4) is -107.647948397019 Stats: nIt(DAVIDSON) = 1 Energy at sites (2, 3) is -107.647948397019 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.647948397019 ****************************************************************** *** Information on left sweep 0 of instruction 0: *** Elapsed wall time = 82.026575 seconds *** |--> S.join = 0.981874 seconds *** |--> S.solve = 73.100322 seconds *** |--> S.split = 2.837766 seconds *** |--> Tensor update = 5.105823 seconds *** |--> create = 0.030077 seconds *** |--> destroy = 0.00179 seconds *** |--> disk write = 0.340472 seconds *** |--> disk read = 0.228402 seconds *** |--> calc = 4.504964 seconds *** Disk write bandwidth = 1.72102372055145 MB/s *** Disk read bandwidth = 2.57416323307904 MB/s *** Minimum energy = -107.647948397019 *** Maximum discarded weight = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (0, 1) is -107.647948397019 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.647948397019 Stats: nIt(DAVIDSON) = 1 Energy at sites (2, 3) is -107.647948397019 Stats: nIt(DAVIDSON) = 1 Energy at sites (3, 4) is -107.647948397019 Stats: nIt(DAVIDSON) = 8 Energy at sites (4, 5) is -107.64795648161 Stats: nIt(DAVIDSON) = 9 Energy at sites (5, 6) is -107.648250111735 Stats: nIt(DAVIDSON) = 1 Energy at sites (6, 7) is -107.648250111734 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -107.648250111734 ****************************************************************** *** Information on right sweep 0 of instruction 0: *** Elapsed wall time = 19.982925 seconds *** |--> S.join = 1.175732 seconds *** |--> S.solve = 11.269525 seconds *** |--> S.split = 2.81713 seconds *** |--> Tensor update = 4.637246 seconds *** |--> create = 0.043682 seconds *** |--> destroy = 0.001668 seconds *** |--> disk write = 0.056549 seconds *** |--> disk read = 0.097383 seconds *** |--> calc = 4.437857 seconds *** Disk write bandwidth = 10.3970721102357 MB/s *** Disk read bandwidth = 6.0170706199603 MB/s *** Minimum energy = -107.648250111735 *** Maximum discarded weight = 0 *** Energy difference with respect to previous leftright sweep = 107.648250111734 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (8, 9) is -107.648250111735 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -107.648250111735 Stats: nIt(DAVIDSON) = 1 Energy at sites (6, 7) is -107.648250111734 Stats: nIt(DAVIDSON) = 1 Energy at sites (5, 6) is -107.648250111734 Stats: nIt(DAVIDSON) = 8 Energy at sites (4, 5) is -107.648250883584 Stats: nIt(DAVIDSON) = 5 Energy at sites (3, 4) is -107.648250971276 Stats: nIt(DAVIDSON) = 1 Energy at sites (2, 3) is -107.648250971276 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.648250971276 ****************************************************************** *** Information on left sweep 1 of instruction 0: *** Elapsed wall time = 18.989753 seconds *** |--> S.join = 0.940512 seconds *** |--> S.solve = 10.077981 seconds *** |--> S.split = 3.142293 seconds *** |--> Tensor update = 4.823737 seconds *** |--> create = 0.107975 seconds *** |--> destroy = 0.001685 seconds *** |--> disk write = 0.261908 seconds *** |--> disk read = 0.189778 seconds *** |--> calc = 4.262292 seconds *** Disk write bandwidth = 2.23727563947491 MB/s *** Disk read bandwidth = 3.09806210815647 MB/s *** Minimum energy = -107.648250971276 *** Maximum discarded weight = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (0, 1) is -107.648250971276 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.648250971276 Stats: nIt(DAVIDSON) = 1 Energy at sites (2, 3) is -107.648250971276 Stats: nIt(DAVIDSON) = 1 Energy at sites (3, 4) is -107.648250971276 Stats: nIt(DAVIDSON) = 2 Energy at sites (4, 5) is -107.648250971306 Stats: nIt(DAVIDSON) = 3 Energy at sites (5, 6) is -107.648250973994 Stats: nIt(DAVIDSON) = 1 Energy at sites (6, 7) is -107.648250973994 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -107.648250973994 ****************************************************************** *** Information on right sweep 1 of instruction 0: *** Elapsed wall time = 16.626164 seconds *** |--> S.join = 1.074619 seconds *** |--> S.solve = 7.457101 seconds *** |--> S.split = 3.036303 seconds *** |--> Tensor update = 4.911519 seconds *** |--> create = 0.04443 seconds *** |--> destroy = 0.001598 seconds *** |--> disk write = 0.497307 seconds *** |--> disk read = 0.182743 seconds *** |--> calc = 4.185336 seconds *** Disk write bandwidth = 1.1822556906734 MB/s *** Disk read bandwidth = 3.20647241308063 MB/s *** Minimum energy = -107.648250973994 *** Maximum discarded weight = 0 *** Energy difference with respect to previous leftright sweep = 8.62259383893615e-07 ****************************************************************** *** Information on completed instruction 0: *** The reduced virtual dimension DSU(2) = 500 *** The total number of reduced MPS variables = 1685 *** Minimum energy encountered during all instructions = -107.648250973994 *** Minimum energy encountered during the last sweep = -107.648250973994 *** Maximum discarded weight during the last sweep = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 6 Energy at sites (8, 9) is -107.648250973994 Stats: nIt(DAVIDSON) = 8 Energy at sites (7, 8) is -107.648250973996 Stats: nIt(DAVIDSON) = 10 Energy at sites (6, 7) is -107.648250973997 Stats: nIt(DAVIDSON) = 9 Energy at sites (5, 6) is -107.648250973998 Stats: nIt(DAVIDSON) = 12 Energy at sites (4, 5) is -107.648250974007 Stats: nIt(DAVIDSON) = 12 Energy at sites (3, 4) is -107.648250974013 Stats: nIt(DAVIDSON) = 1 Energy at sites (2, 3) is -107.648250974013 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.648250974014 ****************************************************************** *** Information on left sweep 0 of instruction 1: *** Elapsed wall time = 30.283725 seconds *** |--> S.join = 0.789799 seconds *** |--> S.solve = 21.604618 seconds *** |--> S.split = 2.857098 seconds *** |--> Tensor update = 5.026925 seconds *** |--> create = 0.038653 seconds *** |--> destroy = 0.001986 seconds *** |--> disk write = 0.467392 seconds *** |--> disk read = 0.224555 seconds *** |--> calc = 4.294234 seconds *** Disk write bandwidth = 1.2536808250539 MB/s *** Disk read bandwidth = 2.61826292338945 MB/s *** Minimum energy = -107.648250974014 *** Maximum discarded weight = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (0, 1) is -107.648250974013 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.648250974014 Stats: nIt(DAVIDSON) = 1 Energy at sites (2, 3) is -107.648250974013 Stats: nIt(DAVIDSON) = 1 Energy at sites (3, 4) is -107.648250974014 Stats: nIt(DAVIDSON) = 8 Energy at sites (4, 5) is -107.648250974013 Stats: nIt(DAVIDSON) = 8 Energy at sites (5, 6) is -107.648250974014 Stats: nIt(DAVIDSON) = 1 Energy at sites (6, 7) is -107.648250974014 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -107.648250974014 ****************************************************************** *** Information on right sweep 0 of instruction 1: *** Elapsed wall time = 19.801986 seconds *** |--> S.join = 1.306813 seconds *** |--> S.solve = 10.900668 seconds *** |--> S.split = 2.866831 seconds *** |--> Tensor update = 4.727143 seconds *** |--> create = 0.263789 seconds *** |--> destroy = 0.00176 seconds *** |--> disk write = 0.154751 seconds *** |--> disk read = 0.141949 seconds *** |--> calc = 4.164794 seconds *** Disk write bandwidth = 3.7992906718646 MB/s *** Disk read bandwidth = 4.1279641856131 MB/s *** Minimum energy = -107.648250974014 *** Maximum discarded weight = 0 *** Energy difference with respect to previous leftright sweep = 1.969624463527e-11 ****************************************************************** *** Information on completed instruction 1: *** The reduced virtual dimension DSU(2) = 1000 *** The total number of reduced MPS variables = 1685 *** Minimum energy encountered during all instructions = -107.648250974014 *** Minimum energy encountered during the last sweep = -107.648250974014 *** Maximum discarded weight during the last sweep = 0 ****************************************************************** ******************************************** *** 2-RDM and Correlations calculation *** ******************************************** N(N-1) = 182 Double trace of DMRG 2-RDM = 182 Econst + 0.5 * trace(2DM-A * Ham) = -107.648250974013 NOON of irrep Ag = [ 1.99999530444325 , 1.99487994134146 , 1.98267954058502 ]. NOON of irrep B2g = [ 0.074871552075985 ]. NOON of irrep B3g = [ 0.0748715522418787 ]. NOON of irrep B1u = [ 1.99999681839222 , 1.98658242718676 , 0.0188079713771871 ]. NOON of irrep B2u = [ 1.9336574461689 ]. NOON of irrep B3u = [ 1.93365744618734 ]. Single-orbital entropies (Hamiltonian index order is used!) = [ 0.000131009422988472 , 0.0515866751658326 , 0.0764971097294453 , 0.257716818576981 , 0.25771681881379 , 8.4715529922692e-05 , 0.046280040322511 , 0.100736304068956 , 0.241506019616919 , 0.241506019648211 ]. Idistance(0) = 1.30939330912062 Idistance(1) = 5.42402998656656 Idistance(2) = 26.7355487395059 *************************************************** *** Timing information 2-RDM and Correlations *** *************************************************** *** Elapsed wall time = 19.870695 seconds *** |--> MPS gauge change = 6.389136 seconds *** |--> Diagram calc = 1.352816 seconds *** |--> Tensor update = 12.127056 seconds *** |--> create = 0.212321 seconds *** |--> destroy = 0.00604400000000001 seconds *** |--> disk write = 1.169335 seconds *** |--> disk read = 0.394724 seconds *** |--> calc = 10.344134 seconds *** Disk write bandwidth = 1.018209539403 MB/s *** Disk read bandwidth = 3.01635586323054 MB/s *************************************************** FCI::Startup : Number of variables in the FCI vector = 1824 FCI::Startup : Without additional loops the FCI matrix-vector product requires a workspace of 0.0625 MB memory. FCI::matvec : Wall time = 311.106386 seconds FCI::matvec : Wall time = 309.51183 seconds FCI::matvec : Wall time = 308.769214 seconds FCI::matvec : Wall time = 315.529678 seconds FCI::matvec : Wall time = 317.090622 seconds FCI::matvec : Wall time = 321.67361 seconds FCI::matvec : Wall time = 304.066165 seconds FCI::matvec : Wall time = 318.978564 seconds FCI::matvec : Wall time = 319.020773 seconds FCI::matvec : Wall time = 334.166231 seconds FCI::matvec : Wall time = 330.924511 seconds FCI::matvec : Wall time = 348.993714 seconds FCI::matvec : Wall time = 331.41101 seconds FCI::matvec : Wall time = 328.10725 seconds FCI::matvec : Wall time = 334.454608 seconds FCI::matvec : Wall time = 323.512787 seconds FCI::matvec : Wall time = 331.204895 seconds FCI::matvec : Wall time = 327.211174 seconds FCI::GSDavidson : Converged ground state energy = -107.648250974013 FCI::CalcSpinSquared : For intended spin 0 the measured S(S+1) = -1.04963828422788e-18 and intended S(S+1) = 0 Info on DMRG::operators rm call to system: 0 CheMPS2: a spin-adapted implementation of DMRG for ab initio quantum chemistry Copyright (C) 2013-2021 Sebastian Wouters This program is free software; you can redistribute it and/or modify it under the terms of the GNU General Public License as published by the Free Software Foundation; either version 2 of the License, or (at your option) any later version. This program is distributed in the hope that it will be useful, but WITHOUT ANY WARRANTY; without even the implied warranty of MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU General Public License for more details. You should have received a copy of the GNU General Public License along with this program; if not, write to the Free Software Foundation, Inc., 51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA. Stats: nIt(DAVIDSON) = 13 Energy at sites (8, 9) is -102.006139928541 Stats: nIt(DAVIDSON) = 42 Energy at sites (7, 8) is -106.33141388775 Stats: nIt(DAVIDSON) = 30 Energy at sites (6, 7) is -106.911484112986 Stats: nIt(DAVIDSON) = 54 Energy at sites (5, 6) is -107.317973512578 Stats: nIt(DAVIDSON) = 47 Energy at sites (4, 5) is -107.32568265261 Stats: nIt(DAVIDSON) = 23 Energy at sites (3, 4) is -107.328763243118 Stats: nIt(DAVIDSON) = 10 Energy at sites (2, 3) is -107.328765004992 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.328765004993 ****************************************************************** *** Information on left sweep 0 of instruction 0: *** Elapsed wall time = 90.293323 seconds *** |--> S.join = 1.33867 seconds *** |--> S.solve = 79.229144 seconds *** |--> S.split = 3.695214 seconds *** |--> Tensor update = 6.029487 seconds *** |--> create = 0.102297 seconds *** |--> destroy = 0.012296 seconds *** |--> disk write = 0.605498 seconds *** |--> disk read = 0.235025 seconds *** |--> calc = 5.074283 seconds *** Disk write bandwidth = 1.39525769635722 MB/s *** Disk read bandwidth = 3.57920128593368 MB/s *** Minimum energy = -107.328765004993 *** Maximum discarded weight = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (0, 1) is -107.328765004992 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.328765004992 Stats: nIt(DAVIDSON) = 1 Energy at sites (2, 3) is -107.328765004992 Stats: nIt(DAVIDSON) = 5 Energy at sites (3, 4) is -107.32876500734 Stats: nIt(DAVIDSON) = 7 Energy at sites (4, 5) is -107.32876714964 Stats: nIt(DAVIDSON) = 7 Energy at sites (5, 6) is -107.32876889215 Stats: nIt(DAVIDSON) = 1 Energy at sites (6, 7) is -107.32876889215 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -107.32876889215 ****************************************************************** *** Information on right sweep 0 of instruction 0: *** Elapsed wall time = 24.807675 seconds *** |--> S.join = 0.9679 seconds *** |--> S.solve = 14.347726 seconds *** |--> S.split = 3.837426 seconds *** |--> Tensor update = 5.650891 seconds *** |--> create = 0.265663 seconds *** |--> destroy = 0.095451 seconds *** |--> disk write = 0.291357 seconds *** |--> disk read = 0.054111 seconds *** |--> calc = 4.944231 seconds *** Disk write bandwidth = 2.88718576257499 MB/s *** Disk read bandwidth = 15.612828161167 MB/s *** Minimum energy = -107.32876889215 *** Maximum discarded weight = 0 *** Energy difference with respect to previous leftright sweep = 107.32876889215 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (8, 9) is -107.32876889215 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -107.32876889215 Stats: nIt(DAVIDSON) = 1 Energy at sites (6, 7) is -107.32876889215 Stats: nIt(DAVIDSON) = 1 Energy at sites (5, 6) is -107.328768892151 Stats: nIt(DAVIDSON) = 3 Energy at sites (4, 5) is -107.32876889256 Stats: nIt(DAVIDSON) = 4 Energy at sites (3, 4) is -107.328768897997 Stats: nIt(DAVIDSON) = 1 Energy at sites (2, 3) is -107.328768897997 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.328768897997 ****************************************************************** *** Information on left sweep 1 of instruction 0: *** Elapsed wall time = 19.915937 seconds *** |--> S.join = 1.269839 seconds *** |--> S.solve = 9.7558 seconds *** |--> S.split = 3.381279 seconds *** |--> Tensor update = 5.405309 seconds *** |--> create = 0.138184 seconds *** |--> destroy = 0.001817 seconds *** |--> disk write = 0.380851 seconds *** |--> disk read = 0.079081 seconds *** |--> calc = 4.805275 seconds *** Disk write bandwidth = 2.21825791353812 MB/s *** Disk read bandwidth = 10.6372173117002 MB/s *** Minimum energy = -107.328768897997 *** Maximum discarded weight = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (0, 1) is -107.328768897997 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.328768897997 Stats: nIt(DAVIDSON) = 1 Energy at sites (2, 3) is -107.328768897997 Stats: nIt(DAVIDSON) = 1 Energy at sites (3, 4) is -107.328768897997 Stats: nIt(DAVIDSON) = 2 Energy at sites (4, 5) is -107.328768898021 Stats: nIt(DAVIDSON) = 1 Energy at sites (5, 6) is -107.328768898021 Stats: nIt(DAVIDSON) = 1 Energy at sites (6, 7) is -107.328768898021 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -107.328768898021 ****************************************************************** *** Information on right sweep 1 of instruction 0: *** Elapsed wall time = 16.976968 seconds *** |--> S.join = 1.424877 seconds *** |--> S.solve = 7.670822 seconds *** |--> S.split = 2.930467 seconds *** |--> Tensor update = 4.847662 seconds *** |--> create = 0.218101 seconds *** |--> destroy = 0.001523 seconds *** |--> disk write = 0.087606 seconds *** |--> disk read = 0.200575 seconds *** |--> calc = 4.339775 seconds *** Disk write bandwidth = 9.60210239283339 MB/s *** Disk read bandwidth = 4.21201916803643 MB/s *** Minimum energy = -107.328768898021 *** Maximum discarded weight = 0 *** Energy difference with respect to previous leftright sweep = 5.87050408284995e-09 ****************************************************************** *** Information on completed instruction 0: *** The reduced virtual dimension DSU(2) = 500 *** The total number of reduced MPS variables = 2280 *** Minimum energy encountered during all instructions = -107.328768898021 *** Minimum energy encountered during the last sweep = -107.328768898021 *** Maximum discarded weight during the last sweep = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 7 Energy at sites (8, 9) is -107.328768898022 Stats: nIt(DAVIDSON) = 10 Energy at sites (7, 8) is -107.328768898026 Stats: nIt(DAVIDSON) = 14 Energy at sites (6, 7) is -107.32876889803 Stats: nIt(DAVIDSON) = 13 Energy at sites (5, 6) is -107.32876889803 Stats: nIt(DAVIDSON) = 11 Energy at sites (4, 5) is -107.32876889803 Stats: nIt(DAVIDSON) = 14 Energy at sites (3, 4) is -107.32876889803 Stats: nIt(DAVIDSON) = 10 Energy at sites (2, 3) is -107.328768898033 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.328768898033 ****************************************************************** *** Information on left sweep 0 of instruction 1: *** Elapsed wall time = 39.808387 seconds *** |--> S.join = 1.322131 seconds *** |--> S.solve = 30.055623 seconds *** |--> S.split = 3.203268 seconds *** |--> Tensor update = 5.158987 seconds *** |--> create = 0.257288 seconds *** |--> destroy = 0.00276 seconds *** |--> disk write = 0.316955 seconds *** |--> disk read = 0.120214 seconds *** |--> calc = 4.461675 seconds *** Disk write bandwidth = 2.66544381577481 MB/s *** Disk read bandwidth = 6.99753591284345 MB/s *** Minimum energy = -107.328768898033 *** Maximum discarded weight = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (0, 1) is -107.328768898033 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.328768898033 Stats: nIt(DAVIDSON) = 1 Energy at sites (2, 3) is -107.328768898033 Stats: nIt(DAVIDSON) = 9 Energy at sites (3, 4) is -107.328768898033 Stats: nIt(DAVIDSON) = 8 Energy at sites (4, 5) is -107.328768898033 Stats: nIt(DAVIDSON) = 8 Energy at sites (5, 6) is -107.328768898033 Stats: nIt(DAVIDSON) = 1 Energy at sites (6, 7) is -107.328768898032 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -107.328768898033 ****************************************************************** *** Information on right sweep 0 of instruction 1: *** Elapsed wall time = 24.000277 seconds *** |--> S.join = 1.34669 seconds *** |--> S.solve = 14.374864 seconds *** |--> S.split = 3.281397 seconds *** |--> Tensor update = 4.99432 seconds *** |--> create = 0.18383 seconds *** |--> destroy = 0.001599 seconds *** |--> disk write = 0.0790960000000001 seconds *** |--> disk read = 0.174168 seconds *** |--> calc = 4.555542 seconds *** Disk write bandwidth = 10.6352000382644 MB/s *** Disk read bandwidth = 4.85063699777747 MB/s *** Minimum energy = -107.328768898033 *** Maximum discarded weight = 0 *** Energy difference with respect to previous leftright sweep = 1.16244791570352e-11 ****************************************************************** *** Information on completed instruction 1: *** The reduced virtual dimension DSU(2) = 1000 *** The total number of reduced MPS variables = 2280 *** Minimum energy encountered during all instructions = -107.328768898033 *** Minimum energy encountered during the last sweep = -107.328768898033 *** Maximum discarded weight during the last sweep = 0 ****************************************************************** ******************************************** *** 2-RDM and Correlations calculation *** ******************************************** N(N-1) = 182 Double trace of DMRG 2-RDM = 182 Econst + 0.5 * trace(2DM-A * Ham) = -107.328768898033 NOON of irrep Ag = [ 1.99999672241048 , 1.99571463015723 , 1.98497373603399 ]. NOON of irrep B2g = [ 0.53898990509922 ]. NOON of irrep B3g = [ 0.538989904978516 ]. NOON of irrep B1u = [ 1.99999702947248 , 1.9914989056241 , 0.019469066844293 ]. NOON of irrep B2u = [ 1.46518504975076 ]. NOON of irrep B3u = [ 1.46518504962894 ]. Single-orbital entropies (Hamiltonian index order is used!) = [ 0.000105862741425952 , 0.058708937365474 , 0.0554792810452132 , 1.11957630006684 , 1.1195763000019 , 8.52797481834355e-05 , 0.0421718621446499 , 0.105000352916151 , 1.11261995849407 , 1.11261995856067 ]. Idistance(0) = 4.60188108193072 Idistance(1) = 17.7825010797388 Idistance(2) = 85.6947708210823 *************************************************** *** Timing information 2-RDM and Correlations *** *************************************************** *** Elapsed wall time = 22.094591 seconds *** |--> MPS gauge change = 8.230045 seconds *** |--> Diagram calc = 1.532312 seconds *** |--> Tensor update = 12.315851 seconds *** |--> create = 0.101119 seconds *** |--> destroy = 0.005392 seconds *** |--> disk write = 0.584653 seconds *** |--> disk read = 0.258241 seconds *** |--> calc = 11.36606 seconds *** Disk write bandwidth = 2.92984732954713 MB/s *** Disk read bandwidth = 6.63312189296711 MB/s *************************************************** FCI::Startup : Number of variables in the FCI vector = 1160 FCI::Startup : Without additional loops the FCI matrix-vector product requires a workspace of 0.0751953125 MB memory. FCI::matvec : Wall time = 320.87954 seconds FCI::matvec : Wall time = 314.391154 seconds FCI::matvec : Wall time = 308.906991 seconds FCI::matvec : Wall time = 311.100605 seconds FCI::matvec : Wall time = 319.480678 seconds FCI::matvec : Wall time = 315.024611 seconds FCI::matvec : Wall time = 314.601892 seconds FCI::matvec : Wall time = 326.08314 seconds FCI::matvec : Wall time = 312.680663 seconds FCI::matvec : Wall time = 316.433211 seconds FCI::matvec : Wall time = 321.167851 seconds FCI::matvec : Wall time = 305.692217 seconds FCI::matvec : Wall time = 319.024255 seconds FCI::matvec : Wall time = 321.205881 seconds FCI::matvec : Wall time = 316.76814 seconds FCI::matvec : Wall time = 313.794362 seconds FCI::matvec : Wall time = 320.301597 seconds FCI::GSDavidson : Converged ground state energy = -107.328768898033 FCI::CalcSpinSquared : For intended spin 1 the measured S(S+1) = 2 and intended S(S+1) = 2 Info on DMRG::operators rm call to system: 0 CheMPS2: a spin-adapted implementation of DMRG for ab initio quantum chemistry Copyright (C) 2013-2021 Sebastian Wouters This program is free software; you can redistribute it and/or modify it under the terms of the GNU General Public License as published by the Free Software Foundation; either version 2 of the License, or (at your option) any later version. This program is distributed in the hope that it will be useful, but WITHOUT ANY WARRANTY; without even the implied warranty of MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU General Public License for more details. You should have received a copy of the GNU General Public License along with this program; if not, write to the Free Software Foundation, Inc., 51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA. Stats: nIt(DAVIDSON) = 11 Energy at sites (8, 9) is -101.559657239377 Stats: nIt(DAVIDSON) = 22 Energy at sites (7, 8) is -106.983647234476 Stats: nIt(DAVIDSON) = 18 Energy at sites (6, 7) is -106.994540630521 Stats: nIt(DAVIDSON) = 19 Energy at sites (5, 6) is -106.995083812373 Stats: nIt(DAVIDSON) = 18 Energy at sites (4, 5) is -106.997339544588 Stats: nIt(DAVIDSON) = 24 Energy at sites (3, 4) is -106.999647390656 Stats: nIt(DAVIDSON) = 13 Energy at sites (2, 3) is -107.007873536401 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.007873536401 ****************************************************************** *** Information on left sweep 0 of instruction 0: *** Elapsed wall time = 52.140358 seconds *** |--> S.join = 1.391371 seconds *** |--> S.solve = 42.625792 seconds *** |--> S.split = 3.264681 seconds *** |--> Tensor update = 4.855716 seconds *** |--> create = 0.04472 seconds *** |--> destroy = 0.001589 seconds *** |--> disk write = 0.243773 seconds *** |--> disk read = 0.122727 seconds *** |--> calc = 4.442806 seconds *** Disk write bandwidth = 0.801112558882264 MB/s *** Disk read bandwidth = 1.58242471333096 MB/s *** Minimum energy = -107.007873536401 *** Maximum discarded weight = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (0, 1) is -107.007873536401 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.007873536401 Stats: nIt(DAVIDSON) = 1 Energy at sites (2, 3) is -107.007873536401 Stats: nIt(DAVIDSON) = 5 Energy at sites (3, 4) is -107.00787373077 Stats: nIt(DAVIDSON) = 10 Energy at sites (4, 5) is -107.007874934625 Stats: nIt(DAVIDSON) = 10 Energy at sites (5, 6) is -107.007920286861 Stats: nIt(DAVIDSON) = 3 Energy at sites (6, 7) is -107.007920287836 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -107.007920287836 ****************************************************************** *** Information on right sweep 0 of instruction 0: *** Elapsed wall time = 23.578206 seconds *** |--> S.join = 1.142926 seconds *** |--> S.solve = 14.118573 seconds *** |--> S.split = 3.233647 seconds *** |--> Tensor update = 5.082496 seconds *** |--> create = 0.117523 seconds *** |--> destroy = 0.083943 seconds *** |--> disk write = 0.228921 seconds *** |--> disk read = 0.239725 seconds *** |--> calc = 4.412287 seconds *** Disk write bandwidth = 0.848354837664385 MB/s *** Disk read bandwidth = 0.814640157749114 MB/s *** Minimum energy = -107.007920287836 *** Maximum discarded weight = 0 *** Energy difference with respect to previous leftright sweep = 107.007920287836 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (8, 9) is -107.007920287836 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -107.007920287836 Stats: nIt(DAVIDSON) = 1 Energy at sites (6, 7) is -107.007920287836 Stats: nIt(DAVIDSON) = 1 Energy at sites (5, 6) is -107.007920287836 Stats: nIt(DAVIDSON) = 3 Energy at sites (4, 5) is -107.00792030307 Stats: nIt(DAVIDSON) = 5 Energy at sites (3, 4) is -107.007920397949 Stats: nIt(DAVIDSON) = 4 Energy at sites (2, 3) is -107.007920596502 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.007920596502 ****************************************************************** *** Information on left sweep 1 of instruction 0: *** Elapsed wall time = 20.218495 seconds *** |--> S.join = 1.009385 seconds *** |--> S.solve = 10.490281 seconds *** |--> S.split = 3.135397 seconds *** |--> Tensor update = 5.582802 seconds *** |--> create = 0.038237 seconds *** |--> destroy = 0.069511 seconds *** |--> disk write = 0.400511 seconds *** |--> disk read = 0.095842 seconds *** |--> calc = 4.9786 seconds *** Disk write bandwidth = 0.487601119111351 MB/s *** Disk read bandwidth = 2.02631662311897 MB/s *** Minimum energy = -107.007920596502 *** Maximum discarded weight = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (0, 1) is -107.007920596502 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.007920596502 Stats: nIt(DAVIDSON) = 1 Energy at sites (2, 3) is -107.007920596502 Stats: nIt(DAVIDSON) = 2 Energy at sites (3, 4) is -107.007920596609 Stats: nIt(DAVIDSON) = 2 Energy at sites (4, 5) is -107.007920596655 Stats: nIt(DAVIDSON) = 3 Energy at sites (5, 6) is -107.007920599387 Stats: nIt(DAVIDSON) = 1 Energy at sites (6, 7) is -107.007920599387 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -107.007920599387 ****************************************************************** *** Information on right sweep 1 of instruction 0: *** Elapsed wall time = 17.811999 seconds *** |--> S.join = 0.776469 seconds *** |--> S.solve = 8.432438 seconds *** |--> S.split = 3.385273 seconds *** |--> Tensor update = 5.217259 seconds *** |--> create = 0.026776 seconds *** |--> destroy = 0.005525 seconds *** |--> disk write = 0.362463 seconds *** |--> disk read = 0.317708 seconds *** |--> calc = 4.504682 seconds *** Disk write bandwidth = 0.535796033782672 MB/s *** Disk read bandwidth = 0.614682701777753 MB/s *** Minimum energy = -107.007920599387 *** Maximum discarded weight = 0 *** Energy difference with respect to previous leftright sweep = 3.1155121860138e-07 ****************************************************************** *** Information on completed instruction 0: *** The reduced virtual dimension DSU(2) = 500 *** The total number of reduced MPS variables = 631 *** Minimum energy encountered during all instructions = -107.007920599387 *** Minimum energy encountered during the last sweep = -107.007920599387 *** Maximum discarded weight during the last sweep = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 7 Energy at sites (8, 9) is -107.007920599391 Stats: nIt(DAVIDSON) = 8 Energy at sites (7, 8) is -107.007920599394 Stats: nIt(DAVIDSON) = 14 Energy at sites (6, 7) is -107.007920599398 Stats: nIt(DAVIDSON) = 13 Energy at sites (5, 6) is -107.007920599398 Stats: nIt(DAVIDSON) = 12 Energy at sites (4, 5) is -107.007920599399 Stats: nIt(DAVIDSON) = 12 Energy at sites (3, 4) is -107.007920599399 Stats: nIt(DAVIDSON) = 10 Energy at sites (2, 3) is -107.007920599438 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.007920599438 ****************************************************************** *** Information on left sweep 0 of instruction 1: *** Elapsed wall time = 36.99935 seconds *** |--> S.join = 0.991225 seconds *** |--> S.solve = 27.880851 seconds *** |--> S.split = 2.898767 seconds *** |--> Tensor update = 5.227857 seconds *** |--> create = 0.135452 seconds *** |--> destroy = 0.001675 seconds *** |--> disk write = 0.238673 seconds *** |--> disk read = 0.236511 seconds *** |--> calc = 4.615449 seconds *** Disk write bandwidth = 0.818230850646727 MB/s *** Disk read bandwidth = 0.821129832409354 MB/s *** Minimum energy = -107.007920599438 *** Maximum discarded weight = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (0, 1) is -107.007920599438 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.007920599438 Stats: nIt(DAVIDSON) = 1 Energy at sites (2, 3) is -107.007920599438 Stats: nIt(DAVIDSON) = 9 Energy at sites (3, 4) is -107.007920599438 Stats: nIt(DAVIDSON) = 11 Energy at sites (4, 5) is -107.007920599438 Stats: nIt(DAVIDSON) = 13 Energy at sites (5, 6) is -107.007920599439 Stats: nIt(DAVIDSON) = 10 Energy at sites (6, 7) is -107.007920599439 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -107.007920599439 ****************************************************************** *** Information on right sweep 0 of instruction 1: *** Elapsed wall time = 27.985215 seconds *** |--> S.join = 1.139188 seconds *** |--> S.solve = 18.571423 seconds *** |--> S.split = 3.150186 seconds *** |--> Tensor update = 5.112441 seconds *** |--> create = 0.090614 seconds *** |--> destroy = 0.001985 seconds *** |--> disk write = 0.204893 seconds *** |--> disk read = 0.211348 seconds *** |--> calc = 4.603109 seconds *** Disk write bandwidth = 0.947842228836362 MB/s *** Disk read bandwidth = 0.924019209154599 MB/s *** Minimum energy = -107.007920599439 *** Maximum discarded weight = 0 *** Energy difference with respect to previous leftright sweep = 5.17275111633353e-11 ****************************************************************** *** Information on completed instruction 1: *** The reduced virtual dimension DSU(2) = 1000 *** The total number of reduced MPS variables = 631 *** Minimum energy encountered during all instructions = -107.007920599439 *** Minimum energy encountered during the last sweep = -107.007920599439 *** Maximum discarded weight during the last sweep = 0 ****************************************************************** ******************************************** *** 2-RDM and Correlations calculation *** ******************************************** N(N-1) = 182 Double trace of DMRG 2-RDM = 182 Econst + 0.5 * trace(2DM-A * Ham) = -107.007920599439 NOON of irrep Ag = [ 1.9999976172856 , 1.99817458715356 , 1.99099529633287 ]. NOON of irrep B2g = [ 0.99915731093584 ]. NOON of irrep B3g = [ 0.99915731101523 ]. NOON of irrep B1u = [ 1.99999763398154 , 1.99356772577583 , 0.0151843202858746 ]. NOON of irrep B2u = [ 1.00188409857015 ]. NOON of irrep B3u = [ 1.00188409866351 ]. Single-orbital entropies (Hamiltonian index order is used!) = [ 4.85624944918489e-05 , 0.0439795130131184 , 0.019122704255655 , 0.710073263515174 , 0.710073262924574 , 0.000114194275585438 , 0.0501988276826836 , 0.0847680566802409 , 0.709393186124383 , 0.709393186687505 ]. Idistance(0) = 1.96740723970416 Idistance(1) = 7.24682976559602 Idistance(2) = 34.6048709918938 *************************************************** *** Timing information 2-RDM and Correlations *** *************************************************** *** Elapsed wall time = 20.431026 seconds *** |--> MPS gauge change = 6.969614 seconds *** |--> Diagram calc = 1.526403 seconds *** |--> Tensor update = 11.933556 seconds *** |--> create = 0.216336 seconds *** |--> destroy = 0.005195 seconds *** |--> disk write = 0.76556 seconds *** |--> disk read = 0.373817 seconds *** |--> calc = 10.572285 seconds *** Disk write bandwidth = 0.534514049432564 MB/s *** Disk read bandwidth = 1.09466015639629 MB/s *************************************************** FCI::Startup : Number of variables in the FCI vector = 276 FCI::Startup : Without additional loops the FCI matrix-vector product requires a workspace of 0.01904296875 MB memory. FCI::matvec : Wall time = 245.113286 seconds FCI::matvec : Wall time = 253.989288 seconds FCI::matvec : Wall time = 251.588493 seconds FCI::matvec : Wall time = 243.51334 seconds FCI::matvec : Wall time = 242.322047 seconds FCI::matvec : Wall time = 244.756058 seconds FCI::matvec : Wall time = 242.821648 seconds FCI::matvec : Wall time = 249.513034 seconds FCI::matvec : Wall time = 241.412591 seconds FCI::matvec : Wall time = 244.503572 seconds FCI::matvec : Wall time = 238.090006 seconds FCI::matvec : Wall time = 239.841636 seconds FCI::GSDavidson : Converged ground state energy = -107.007920599438 FCI::CalcSpinSquared : For intended spin 2 the measured S(S+1) = 6.00000000000001 and intended S(S+1) = 6 Info on DMRG::operators rm call to system: 0 CheMPS2: a spin-adapted implementation of DMRG for ab initio quantum chemistry Copyright (C) 2013-2021 Sebastian Wouters This program is free software; you can redistribute it and/or modify it under the terms of the GNU General Public License as published by the Free Software Foundation; either version 2 of the License, or (at your option) any later version. This program is distributed in the hope that it will be useful, but WITHOUT ANY WARRANTY; without even the implied warranty of MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU General Public License for more details. You should have received a copy of the GNU General Public License along with this program; if not, write to the Free Software Foundation, Inc., 51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA. Stats: nIt(DAVIDSON) = 12 Energy at sites (8, 9) is -104.828233603875 Stats: nIt(DAVIDSON) = 22 Energy at sites (7, 8) is -105.792503758019 Stats: nIt(DAVIDSON) = 62 Energy at sites (6, 7) is -105.904753188699 Stats: nIt(DAVIDSON) = 49 Energy at sites (5, 6) is -105.910317775828 Stats: nIt(DAVIDSON) = 28 Energy at sites (4, 5) is -106.107443214103 Stats: nIt(DAVIDSON) = 41 Energy at sites (3, 4) is -106.159383177067 Stats: nIt(DAVIDSON) = 4 Energy at sites (2, 3) is -106.159383381027 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -106.159383381027 ****************************************************************** *** Information on left sweep 0 of instruction 0: *** Elapsed wall time = 91.304877 seconds *** |--> S.join = 1.133331 seconds *** |--> S.solve = 81.642903 seconds *** |--> S.split = 3.368502 seconds *** |--> Tensor update = 5.159394 seconds *** |--> create = 0.120019 seconds *** |--> destroy = 0.002009 seconds *** |--> disk write = 0.311554 seconds *** |--> disk read = 0.155342 seconds *** |--> calc = 4.570346 seconds *** Disk write bandwidth = 0.647908614583066 MB/s *** Disk read bandwidth = 1.2924717493297 MB/s *** Minimum energy = -106.159383381027 *** Maximum discarded weight = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (0, 1) is -106.159383381027 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -106.159383381027 Stats: nIt(DAVIDSON) = 1 Energy at sites (2, 3) is -106.159383381027 Stats: nIt(DAVIDSON) = 2 Energy at sites (3, 4) is -106.159383381047 Stats: nIt(DAVIDSON) = 12 Energy at sites (4, 5) is -106.159907276455 Stats: nIt(DAVIDSON) = 11 Energy at sites (5, 6) is -106.190926138216 Stats: nIt(DAVIDSON) = 2 Energy at sites (6, 7) is -106.190926140415 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -106.190926140415 ****************************************************************** *** Information on right sweep 0 of instruction 0: *** Elapsed wall time = 23.737468 seconds *** |--> S.join = 1.422579 seconds *** |--> S.solve = 14.16094 seconds *** |--> S.split = 3.269344 seconds *** |--> Tensor update = 4.884018 seconds *** |--> create = 0.052652 seconds *** |--> destroy = 0.001699 seconds *** |--> disk write = 0.184949 seconds *** |--> disk read = 0.257322 seconds *** |--> calc = 4.387293 seconds *** Disk write bandwidth = 1.0855703274112 MB/s *** Disk read bandwidth = 0.784458851197381 MB/s *** Minimum energy = -106.190926140415 *** Maximum discarded weight = 0 *** Energy difference with respect to previous leftright sweep = 106.190926140415 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (8, 9) is -106.190926140415 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -106.190926140415 Stats: nIt(DAVIDSON) = 1 Energy at sites (6, 7) is -106.190926140415 Stats: nIt(DAVIDSON) = 1 Energy at sites (5, 6) is -106.190926140415 Stats: nIt(DAVIDSON) = 11 Energy at sites (4, 5) is -106.191441208902 Stats: nIt(DAVIDSON) = 8 Energy at sites (3, 4) is -106.191457676555 Stats: nIt(DAVIDSON) = 4 Energy at sites (2, 3) is -106.191457699417 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -106.191457699417 ****************************************************************** *** Information on left sweep 1 of instruction 0: *** Elapsed wall time = 22.058765 seconds *** |--> S.join = 1.349653 seconds *** |--> S.solve = 12.929067 seconds *** |--> S.split = 2.994155 seconds *** |--> Tensor update = 4.697375 seconds *** |--> create = 0.100619 seconds *** |--> destroy = 0.002735 seconds *** |--> disk write = 0.128063 seconds *** |--> disk read = 0.02425 seconds *** |--> calc = 4.441611 seconds *** Disk write bandwidth = 1.57624388393066 MB/s *** Disk read bandwidth = 8.27938748389175 MB/s *** Minimum energy = -106.191457699417 *** Maximum discarded weight = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (0, 1) is -106.191457699417 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -106.191457699417 Stats: nIt(DAVIDSON) = 1 Energy at sites (2, 3) is -106.191457699417 Stats: nIt(DAVIDSON) = 1 Energy at sites (3, 4) is -106.191457699417 Stats: nIt(DAVIDSON) = 4 Energy at sites (4, 5) is -106.191457707936 Stats: nIt(DAVIDSON) = 10 Energy at sites (5, 6) is -106.191466489992 Stats: nIt(DAVIDSON) = 2 Energy at sites (6, 7) is -106.191466490011 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -106.191466490011 ****************************************************************** *** Information on right sweep 1 of instruction 0: *** Elapsed wall time = 20.524507 seconds *** |--> S.join = 1.155921 seconds *** |--> S.solve = 11.074383 seconds *** |--> S.split = 3.127829 seconds *** |--> Tensor update = 5.165613 seconds *** |--> create = 0.147891 seconds *** |--> destroy = 0.001546 seconds *** |--> disk write = 0.314249 seconds *** |--> disk read = 0.230743 seconds *** |--> calc = 4.471091 seconds *** Disk write bandwidth = 0.638904647220437 MB/s *** Disk read bandwidth = 0.874819693372334 MB/s *** Minimum energy = -106.191466490011 *** Maximum discarded weight = 0 *** Energy difference with respect to previous leftright sweep = 0.000540349595127054 ****************************************************************** *** Information on completed instruction 0: *** The reduced virtual dimension DSU(2) = 500 *** The total number of reduced MPS variables = 621 *** Minimum energy encountered during all instructions = -106.191466490011 *** Minimum energy encountered during the last sweep = -106.191466490011 *** Maximum discarded weight during the last sweep = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 8 Energy at sites (8, 9) is -106.191466490012 Stats: nIt(DAVIDSON) = 9 Energy at sites (7, 8) is -106.191466490012 Stats: nIt(DAVIDSON) = 9 Energy at sites (6, 7) is -106.191466490012 Stats: nIt(DAVIDSON) = 13 Energy at sites (5, 6) is -106.191466490018 Stats: nIt(DAVIDSON) = 18 Energy at sites (4, 5) is -106.191466534584 Stats: nIt(DAVIDSON) = 18 Energy at sites (3, 4) is -106.191466572098 Stats: nIt(DAVIDSON) = 7 Energy at sites (2, 3) is -106.191466572113 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -106.191466572113 ****************************************************************** *** Information on left sweep 0 of instruction 1: *** Elapsed wall time = 38.897598 seconds *** |--> S.join = 1.130363 seconds *** |--> S.solve = 29.620887 seconds *** |--> S.split = 3.079118 seconds *** |--> Tensor update = 5.066697 seconds *** |--> create = 0.067531 seconds *** |--> destroy = 0.021953 seconds *** |--> disk write = 0.309243 seconds *** |--> disk read = 0.037636 seconds *** |--> calc = 4.63023 seconds *** Disk write bandwidth = 0.652750492356537 MB/s *** Disk read bandwidth = 5.33465688395087 MB/s *** Minimum energy = -106.191466572113 *** Maximum discarded weight = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (0, 1) is -106.191466572113 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -106.191466572113 Stats: nIt(DAVIDSON) = 1 Energy at sites (2, 3) is -106.191466572113 Stats: nIt(DAVIDSON) = 6 Energy at sites (3, 4) is -106.191466572113 Stats: nIt(DAVIDSON) = 13 Energy at sites (4, 5) is -106.19146657213 Stats: nIt(DAVIDSON) = 18 Energy at sites (5, 6) is -106.191466575741 Stats: nIt(DAVIDSON) = 3 Energy at sites (6, 7) is -106.191466575741 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -106.191466575741 ****************************************************************** *** Information on right sweep 0 of instruction 1: *** Elapsed wall time = 26.780785 seconds *** |--> S.join = 1.129782 seconds *** |--> S.solve = 17.751686 seconds *** |--> S.split = 3.094202 seconds *** |--> Tensor update = 4.804582 seconds *** |--> create = 0.162536 seconds *** |--> destroy = 0.013732 seconds *** |--> disk write = 0.218671 seconds *** |--> disk read = 0.069319 seconds *** |--> calc = 4.340236 seconds *** Disk write bandwidth = 0.918160828296276 MB/s *** Disk read bandwidth = 2.91202297361203 MB/s *** Minimum energy = -106.191466575741 *** Maximum discarded weight = 0 *** Energy difference with respect to previous leftright sweep = 8.57303916745877e-08 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (8, 9) is -106.191466575741 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -106.191466575741 Stats: nIt(DAVIDSON) = 1 Energy at sites (6, 7) is -106.191466575741 Stats: nIt(DAVIDSON) = 2 Energy at sites (5, 6) is -106.191466575741 Stats: nIt(DAVIDSON) = 14 Energy at sites (4, 5) is -106.19146657583 Stats: nIt(DAVIDSON) = 16 Energy at sites (3, 4) is -106.191466575938 Stats: nIt(DAVIDSON) = 5 Energy at sites (2, 3) is -106.191466575938 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -106.191466575938 ****************************************************************** *** Information on left sweep 1 of instruction 1: *** Elapsed wall time = 27.336134 seconds *** |--> S.join = 1.244196 seconds *** |--> S.solve = 17.49913 seconds *** |--> S.split = 3.307662 seconds *** |--> Tensor update = 5.284577 seconds *** |--> create = 0.124275 seconds *** |--> destroy = 0.001785 seconds *** |--> disk write = 0.289754 seconds *** |--> disk read = 0.184263 seconds *** |--> calc = 4.684396 seconds *** Disk write bandwidth = 0.696654819287439 MB/s *** Disk read bandwidth = 1.08961184005674 MB/s *** Minimum energy = -106.191466575938 *** Maximum discarded weight = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (0, 1) is -106.191466575938 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -106.191466575938 Stats: nIt(DAVIDSON) = 1 Energy at sites (2, 3) is -106.191466575938 Stats: nIt(DAVIDSON) = 2 Energy at sites (3, 4) is -106.191466575938 Stats: nIt(DAVIDSON) = 10 Energy at sites (4, 5) is -106.191466575938 Stats: nIt(DAVIDSON) = 14 Energy at sites (5, 6) is -106.191466575949 Stats: nIt(DAVIDSON) = 3 Energy at sites (6, 7) is -106.191466575949 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -106.191466575949 ****************************************************************** *** Information on right sweep 1 of instruction 1: *** Elapsed wall time = 23.902857 seconds *** |--> S.join = 1.274736 seconds *** |--> S.solve = 14.389556 seconds *** |--> S.split = 3.021793 seconds *** |--> Tensor update = 5.213346 seconds *** |--> create = 0.201908 seconds *** |--> destroy = 0.005357 seconds *** |--> disk write = 0.307784 seconds *** |--> disk read = 0.117101 seconds *** |--> calc = 4.581075 seconds *** Disk write bandwidth = 0.652324833273903 MB/s *** Disk read bandwidth = 1.7237984347513 MB/s *** Minimum energy = -106.191466575949 *** Maximum discarded weight = 0 *** Energy difference with respect to previous leftright sweep = 2.08444816962583e-10 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (8, 9) is -106.191466575949 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -106.191466575949 Stats: nIt(DAVIDSON) = 1 Energy at sites (6, 7) is -106.191466575949 Stats: nIt(DAVIDSON) = 2 Energy at sites (5, 6) is -106.19146657595 Stats: nIt(DAVIDSON) = 11 Energy at sites (4, 5) is -106.19146657595 Stats: nIt(DAVIDSON) = 13 Energy at sites (3, 4) is -106.19146657595 Stats: nIt(DAVIDSON) = 4 Energy at sites (2, 3) is -106.19146657595 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -106.19146657595 ****************************************************************** *** Information on left sweep 2 of instruction 1: *** Elapsed wall time = 24.962268 seconds *** |--> S.join = 1.176645 seconds *** |--> S.solve = 15.219259 seconds *** |--> S.split = 3.081363 seconds *** |--> Tensor update = 5.484368 seconds *** |--> create = 0.192515 seconds *** |--> destroy = 0.00192 seconds *** |--> disk write = 0.585351 seconds *** |--> disk read = 0.044493 seconds *** |--> calc = 4.659982 seconds *** Disk write bandwidth = 0.344850389779487 MB/s *** Disk read bandwidth = 4.51251087776448 MB/s *** Minimum energy = -106.19146657595 *** Maximum discarded weight = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (0, 1) is -106.19146657595 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -106.19146657595 Stats: nIt(DAVIDSON) = 1 Energy at sites (2, 3) is -106.19146657595 Stats: nIt(DAVIDSON) = 1 Energy at sites (3, 4) is -106.19146657595 Stats: nIt(DAVIDSON) = 6 Energy at sites (4, 5) is -106.19146657595 Stats: nIt(DAVIDSON) = 11 Energy at sites (5, 6) is -106.19146657595 Stats: nIt(DAVIDSON) = 2 Energy at sites (6, 7) is -106.19146657595 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -106.19146657595 ****************************************************************** *** Information on right sweep 2 of instruction 1: *** Elapsed wall time = 20.905337 seconds *** |--> S.join = 1.108357 seconds *** |--> S.solve = 11.338198 seconds *** |--> S.split = 3.162604 seconds *** |--> Tensor update = 5.284572 seconds *** |--> create = 0.021491 seconds *** |--> destroy = 0.002831 seconds *** |--> disk write = 0.446447 seconds *** |--> disk read = 0.261913 seconds *** |--> calc = 4.551773 seconds *** Disk write bandwidth = 0.449717763775711 MB/s *** Disk read bandwidth = 0.770708290569054 MB/s *** Minimum energy = -106.19146657595 *** Maximum discarded weight = 0 *** Energy difference with respect to previous leftright sweep = 6.53699316899292e-13 ****************************************************************** *** Information on completed instruction 1: *** The reduced virtual dimension DSU(2) = 1000 *** The total number of reduced MPS variables = 621 *** Minimum energy encountered during all instructions = -106.19146657595 *** Minimum energy encountered during the last sweep = -106.19146657595 *** Maximum discarded weight during the last sweep = 0 ****************************************************************** ******************************************** *** 2-RDM and Correlations calculation *** ******************************************** N(N-1) = 182 Double trace of DMRG 2-RDM = 182 Econst + 0.5 * trace(2DM-A * Ham) = -106.19146657595 NOON of irrep Ag = [ 1.99999399659619 , 1.99366325535722 , 1.87190048691238 ]. NOON of irrep B2g = [ 0.58481428051012 ]. NOON of irrep B3g = [ 0.584814289348673 ]. NOON of irrep B1u = [ 1.99999783389184 , 1.12096429315832 , 1.00219410607063 ]. NOON of irrep B2u = [ 1.42082872286279 ]. NOON of irrep B3u = [ 1.42082873529184 ]. Single-orbital entropies (Hamiltonian index order is used!) = [ 8.17128306686572e-05 , 0.0722109572820134 , 0.460791923941637 , 1.13075779936611 , 1.13075779886369 , 6.17502945807364e-05 , 0.977139016534821 , 0.735936488638466 , 1.12042723504162 , 1.12042722906191 ]. Idistance(0) = 5.65234396814559 Idistance(1) = 19.8382957477001 Idistance(2) = 88.819540905619 *************************************************** *** Timing information 2-RDM and Correlations *** *************************************************** *** Elapsed wall time = 21.81748 seconds *** |--> MPS gauge change = 7.284145 seconds *** |--> Diagram calc = 1.528505 seconds *** |--> Tensor update = 13.003705 seconds *** |--> create = 0.368681 seconds *** |--> destroy = 0.00737000000000001 seconds *** |--> disk write = 0.871681 seconds *** |--> disk read = 0.332517 seconds *** |--> calc = 11.42302 seconds *** Disk write bandwidth = 0.484512560290297 MB/s *** Disk read bandwidth = 1.27013173181042 MB/s *************************************************** FCI::Startup : Number of variables in the FCI vector = 276 FCI::Startup : Without additional loops the FCI matrix-vector product requires a workspace of 0.01904296875 MB memory. FCI::matvec : Wall time = 244.209801 seconds FCI::matvec : Wall time = 233.434027 seconds FCI::matvec : Wall time = 229.760845 seconds FCI::matvec : Wall time = 230.80983 seconds FCI::matvec : Wall time = 231.091912 seconds FCI::matvec : Wall time = 231.69351 seconds FCI::matvec : Wall time = 230.116284 seconds FCI::matvec : Wall time = 235.783288 seconds FCI::matvec : Wall time = 242.807909 seconds FCI::matvec : Wall time = 253.598898 seconds FCI::matvec : Wall time = 260.309227 seconds FCI::matvec : Wall time = 258.996529 seconds FCI::matvec : Wall time = 256.380354 seconds FCI::matvec : Wall time = 254.00466 seconds FCI::matvec : Wall time = 251.196169 seconds FCI::matvec : Wall time = 249.105291 seconds FCI::matvec : Wall time = 245.004037 seconds FCI::matvec : Wall time = 241.882853 seconds FCI::GSDavidson : Converged ground state energy = -106.19146657595 FCI::CalcSpinSquared : For intended spin 2 the measured S(S+1) = 6 and intended S(S+1) = 6 Info on DMRG::operators rm call to system: 0 CheMPS2: a spin-adapted implementation of DMRG for ab initio quantum chemistry Copyright (C) 2013-2021 Sebastian Wouters This program is free software; you can redistribute it and/or modify it under the terms of the GNU General Public License as published by the Free Software Foundation; either version 2 of the License, or (at your option) any later version. This program is distributed in the hope that it will be useful, but WITHOUT ANY WARRANTY; without even the implied warranty of MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU General Public License for more details. You should have received a copy of the GNU General Public License along with this program; if not, write to the Free Software Foundation, Inc., 51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA. Stats: nIt(DAVIDSON) = 11 Energy at sites (8, 9) is -103.686248918947 Stats: nIt(DAVIDSON) = 30 Energy at sites (7, 8) is -106.585015915767 Stats: nIt(DAVIDSON) = 36 Energy at sites (6, 7) is -106.783397038072 Stats: nIt(DAVIDSON) = 55 Energy at sites (5, 6) is -107.289382174 Stats: nIt(DAVIDSON) = 32 Energy at sites (4, 5) is -107.345985573059 Stats: nIt(DAVIDSON) = 17 Energy at sites (3, 4) is -107.346096390211 Stats: nIt(DAVIDSON) = 9 Energy at sites (2, 3) is -107.346097592158 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.346097592158 ****************************************************************** *** Information on left sweep 0 of instruction 0: *** Elapsed wall time = 74.505489 seconds *** |--> S.join = 1.113708 seconds *** |--> S.solve = 65.214939 seconds *** |--> S.split = 3.044955 seconds *** |--> Tensor update = 5.131249 seconds *** |--> create = 0.031693 seconds *** |--> destroy = 0.001728 seconds *** |--> disk write = 0.391598 seconds *** |--> disk read = 0.101936 seconds *** |--> calc = 4.604196 seconds *** Disk write bandwidth = 2.09088560486455 MB/s *** Disk read bandwidth = 7.99680837674037 MB/s *** Minimum energy = -107.346097592158 *** Maximum discarded weight = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (0, 1) is -107.346097592158 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.346097592158 Stats: nIt(DAVIDSON) = 1 Energy at sites (2, 3) is -107.346097592158 Stats: nIt(DAVIDSON) = 3 Energy at sites (3, 4) is -107.346097592957 Stats: nIt(DAVIDSON) = 4 Energy at sites (4, 5) is -107.346097649366 Stats: nIt(DAVIDSON) = 12 Energy at sites (5, 6) is -107.346320946101 Stats: nIt(DAVIDSON) = 5 Energy at sites (6, 7) is -107.346325709911 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -107.346325709911 ****************************************************************** *** Information on right sweep 0 of instruction 0: *** Elapsed wall time = 22.484457 seconds *** |--> S.join = 1.142068 seconds *** |--> S.solve = 13.365049 seconds *** |--> S.split = 2.936515 seconds *** |--> Tensor update = 5.040287 seconds *** |--> create = 0.124114 seconds *** |--> destroy = 0.080285 seconds *** |--> disk write = 0.283023 seconds *** |--> disk read = 0.136651 seconds *** |--> calc = 4.416114 seconds *** Disk write bandwidth = 2.88019934313256 MB/s *** Disk read bandwidth = 5.99180848360971 MB/s *** Minimum energy = -107.346325709911 *** Maximum discarded weight = 0 *** Energy difference with respect to previous leftright sweep = 107.346325709911 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (8, 9) is -107.346325709911 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -107.346325709911 Stats: nIt(DAVIDSON) = 1 Energy at sites (6, 7) is -107.346325709911 Stats: nIt(DAVIDSON) = 5 Energy at sites (5, 6) is -107.346325714292 Stats: nIt(DAVIDSON) = 6 Energy at sites (4, 5) is -107.346326005911 Stats: nIt(DAVIDSON) = 5 Energy at sites (3, 4) is -107.346326112779 Stats: nIt(DAVIDSON) = 2 Energy at sites (2, 3) is -107.346326112881 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.346326112881 ****************************************************************** *** Information on left sweep 1 of instruction 0: *** Elapsed wall time = 20.0115 seconds *** |--> S.join = 1.427619 seconds *** |--> S.solve = 11.023297 seconds *** |--> S.split = 2.8426 seconds *** |--> Tensor update = 4.704401 seconds *** |--> create = 0.193777 seconds *** |--> destroy = 0.001728 seconds *** |--> disk write = 0.256837 seconds *** |--> disk read = 0.034494 seconds *** |--> calc = 4.217481 seconds *** Disk write bandwidth = 3.18796209694768 MB/s *** Disk read bandwidth = 23.6320130657913 MB/s *** Minimum energy = -107.346326112881 *** Maximum discarded weight = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (0, 1) is -107.346326112881 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.346326112881 Stats: nIt(DAVIDSON) = 1 Energy at sites (2, 3) is -107.346326112881 Stats: nIt(DAVIDSON) = 1 Energy at sites (3, 4) is -107.346326112881 Stats: nIt(DAVIDSON) = 2 Energy at sites (4, 5) is -107.34632611297 Stats: nIt(DAVIDSON) = 3 Energy at sites (5, 6) is -107.346326114958 Stats: nIt(DAVIDSON) = 1 Energy at sites (6, 7) is -107.346326114959 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -107.346326114959 ****************************************************************** *** Information on right sweep 1 of instruction 0: *** Elapsed wall time = 17.004472 seconds *** |--> S.join = 1.199161 seconds *** |--> S.solve = 7.990434 seconds *** |--> S.split = 2.97843 seconds *** |--> Tensor update = 4.74788 seconds *** |--> create = 0.183443 seconds *** |--> destroy = 0.117866 seconds *** |--> disk write = 0.102406 seconds *** |--> disk read = 0.122191 seconds *** |--> calc = 4.22189 seconds *** Disk write bandwidth = 7.96010642629735 MB/s *** Disk read bandwidth = 6.70087503247989 MB/s *** Minimum energy = -107.346326114959 *** Maximum discarded weight = 0 *** Energy difference with respect to previous leftright sweep = 4.05047501317313e-07 ****************************************************************** *** Information on completed instruction 0: *** The reduced virtual dimension DSU(2) = 500 *** The total number of reduced MPS variables = 2128 *** Minimum energy encountered during all instructions = -107.346326114959 *** Minimum energy encountered during the last sweep = -107.346326114959 *** Maximum discarded weight during the last sweep = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 7 Energy at sites (8, 9) is -107.346326114961 Stats: nIt(DAVIDSON) = 10 Energy at sites (7, 8) is -107.346326115002 Stats: nIt(DAVIDSON) = 12 Energy at sites (6, 7) is -107.346326115004 Stats: nIt(DAVIDSON) = 18 Energy at sites (5, 6) is -107.346326115006 Stats: nIt(DAVIDSON) = 11 Energy at sites (4, 5) is -107.346326115021 Stats: nIt(DAVIDSON) = 13 Energy at sites (3, 4) is -107.346326115024 Stats: nIt(DAVIDSON) = 9 Energy at sites (2, 3) is -107.346326115024 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.346326115024 ****************************************************************** *** Information on left sweep 0 of instruction 1: *** Elapsed wall time = 38.511103 seconds *** |--> S.join = 0.949765 seconds *** |--> S.solve = 29.477217 seconds *** |--> S.split = 3.04885 seconds *** |--> Tensor update = 5.03009 seconds *** |--> create = 0.042998 seconds *** |--> destroy = 0.001965 seconds *** |--> disk write = 0.352848 seconds *** |--> disk read = 0.332373 seconds *** |--> calc = 4.299805 seconds *** Disk write bandwidth = 2.320508040555 MB/s *** Disk read bandwidth = 2.45255378352455 MB/s *** Minimum energy = -107.346326115024 *** Maximum discarded weight = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (0, 1) is -107.346326115024 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.346326115024 Stats: nIt(DAVIDSON) = 1 Energy at sites (2, 3) is -107.346326115024 Stats: nIt(DAVIDSON) = 7 Energy at sites (3, 4) is -107.346326115024 Stats: nIt(DAVIDSON) = 6 Energy at sites (4, 5) is -107.346326115024 Stats: nIt(DAVIDSON) = 14 Energy at sites (5, 6) is -107.346326115025 Stats: nIt(DAVIDSON) = 6 Energy at sites (6, 7) is -107.346326115024 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -107.346326115024 ****************************************************************** *** Information on right sweep 0 of instruction 1: *** Elapsed wall time = 24.809197 seconds *** |--> S.join = 0.856781 seconds *** |--> S.solve = 15.997621 seconds *** |--> S.split = 3.031546 seconds *** |--> Tensor update = 4.922661 seconds *** |--> create = 0.119548 seconds *** |--> destroy = 0.018831 seconds *** |--> disk write = 0.495728 seconds *** |--> disk read = 0.216627 seconds *** |--> calc = 4.071827 seconds *** Disk write bandwidth = 1.64437485615379 MB/s *** Disk read bandwidth = 3.77970715143426 MB/s *** Minimum energy = -107.346326115025 *** Maximum discarded weight = 0 *** Energy difference with respect to previous leftright sweep = 6.57109922030941e-11 ****************************************************************** *** Information on completed instruction 1: *** The reduced virtual dimension DSU(2) = 1000 *** The total number of reduced MPS variables = 2128 *** Minimum energy encountered during all instructions = -107.346326115025 *** Minimum energy encountered during the last sweep = -107.346326115025 *** Maximum discarded weight during the last sweep = 0 ****************************************************************** ******************************************** *** 2-RDM and Correlations calculation *** ******************************************** N(N-1) = 182 Double trace of DMRG 2-RDM = 182 Econst + 0.5 * trace(2DM-A * Ham) = -107.346326115024 NOON of irrep Ag = [ 1.99999018535263 , 1.99292175207814 , 1.03221285772327 ]. NOON of irrep B2g = [ 1.02415310261532 ]. NOON of irrep B3g = [ 0.0896934291011405 ]. NOON of irrep B1u = [ 1.99999295584652 , 1.9503915427486 , 0.0159495092819364 ]. NOON of irrep B2u = [ 1.91962159255857 ]. NOON of irrep B3u = [ 1.97507307269386 ]. Single-orbital entropies (Hamiltonian index order is used!) = [ 0.000121323007956959 , 0.0447141508113792 , 0.838966990355754 , 0.79065895904228 , 0.317368561616788 , 9.24989496586177e-05 , 0.227634117672746 , 0.0907424570280036 , 0.299652805532047 , 0.133979296090439 ]. Idistance(0) = 1.57215407967157 Idistance(1) = 5.15805448988104 Idistance(2) = 21.9866410437529 *************************************************** *** Timing information 2-RDM and Correlations *** *************************************************** *** Elapsed wall time = 20.201026 seconds *** |--> MPS gauge change = 6.533286 seconds *** |--> Diagram calc = 1.45436 seconds *** |--> Tensor update = 12.210042 seconds *** |--> create = 0.223789 seconds *** |--> destroy = 0.005441 seconds *** |--> disk write = 1.132461 seconds *** |--> disk read = 0.472879 seconds *** |--> calc = 10.375119 seconds *** Disk write bandwidth = 1.46659865875417 MB/s *** Disk read bandwidth = 3.51224263224082 MB/s *************************************************** FCI::Startup : Number of variables in the FCI vector = 1182 FCI::Startup : Without additional loops the FCI matrix-vector product requires a workspace of 0.06982421875 MB memory. FCI::matvec : Wall time = 322.489735 seconds FCI::matvec : Wall time = 322.815575 seconds FCI::matvec : Wall time = 331.491759 seconds FCI::matvec : Wall time = 351.078051 seconds FCI::matvec : Wall time = 329.513002 seconds FCI::matvec : Wall time = 334.107667 seconds FCI::matvec : Wall time = 327.894957 seconds FCI::matvec : Wall time = 323.583963 seconds FCI::matvec : Wall time = 317.379062 seconds FCI::matvec : Wall time = 312.607332 seconds FCI::matvec : Wall time = 338.408295 seconds FCI::matvec : Wall time = 324.279933 seconds FCI::matvec : Wall time = 315.095098 seconds FCI::matvec : Wall time = 326.793739 seconds FCI::matvec : Wall time = 329.41342 seconds FCI::matvec : Wall time = 332.48609 seconds FCI::matvec : Wall time = 326.806771 seconds FCI::matvec : Wall time = 324.415383 seconds FCI::GSDavidson : Converged ground state energy = -107.346326115024 FCI::CalcSpinSquared : For intended spin 1 the measured S(S+1) = 2 and intended S(S+1) = 2 Info on DMRG::operators rm call to system: 0 CheMPS2: a spin-adapted implementation of DMRG for ab initio quantum chemistry Copyright (C) 2013-2021 Sebastian Wouters This program is free software; you can redistribute it and/or modify it under the terms of the GNU General Public License as published by the Free Software Foundation; either version 2 of the License, or (at your option) any later version. This program is distributed in the hope that it will be useful, but WITHOUT ANY WARRANTY; without even the implied warranty of MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU General Public License for more details. You should have received a copy of the GNU General Public License along with this program; if not, write to the Free Software Foundation, Inc., 51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA. Stats: nIt(DAVIDSON) = 18 Energy at sites (8, 9) is -103.144243576936 Stats: nIt(DAVIDSON) = 53 Energy at sites (7, 8) is -106.24040246283 Stats: nIt(DAVIDSON) = 44 Energy at sites (6, 7) is -106.949745264688 Stats: nIt(DAVIDSON) = 70 Energy at sites (5, 6) is -107.184795386521 Stats: nIt(DAVIDSON) = 40 Energy at sites (4, 5) is -107.189525651555 Stats: nIt(DAVIDSON) = 38 Energy at sites (3, 4) is -107.19954208752 Stats: nIt(DAVIDSON) = 10 Energy at sites (2, 3) is -107.199565980986 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.199565980986 ****************************************************************** *** Information on left sweep 0 of instruction 0: *** Elapsed wall time = 95.716495 seconds *** |--> S.join = 1.277598 seconds *** |--> S.solve = 86.296751 seconds *** |--> S.split = 3.065172 seconds *** |--> Tensor update = 5.07646 seconds *** |--> create = 0.073628 seconds *** |--> destroy = 0.001608 seconds *** |--> disk write = 0.196991 seconds *** |--> disk read = 0.256046 seconds *** |--> calc = 4.548083 seconds *** Disk write bandwidth = 4.2701387070626 MB/s *** Disk read bandwidth = 3.27111117393213 MB/s *** Minimum energy = -107.199565980986 *** Maximum discarded weight = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (0, 1) is -107.199565980986 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.199565980986 Stats: nIt(DAVIDSON) = 1 Energy at sites (2, 3) is -107.199565980986 Stats: nIt(DAVIDSON) = 5 Energy at sites (3, 4) is -107.199565986083 Stats: nIt(DAVIDSON) = 8 Energy at sites (4, 5) is -107.199574489168 Stats: nIt(DAVIDSON) = 16 Energy at sites (5, 6) is -107.199602227498 Stats: nIt(DAVIDSON) = 10 Energy at sites (6, 7) is -107.199617215047 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -107.199617215047 ****************************************************************** *** Information on right sweep 0 of instruction 0: *** Elapsed wall time = 26.582243 seconds *** |--> S.join = 1.242654 seconds *** |--> S.solve = 17.502593 seconds *** |--> S.split = 3.046825 seconds *** |--> Tensor update = 4.789587 seconds *** |--> create = 0.195355 seconds *** |--> destroy = 0.00169 seconds *** |--> disk write = 0.031093 seconds *** |--> disk read = 0.189487 seconds *** |--> calc = 4.371871 seconds *** Disk write bandwidth = 26.9370897514111 MB/s *** Disk read bandwidth = 4.43924329396195 MB/s *** Minimum energy = -107.199617215047 *** Maximum discarded weight = 0 *** Energy difference with respect to previous leftright sweep = 107.199617215047 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (8, 9) is -107.199617215047 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -107.199617215047 Stats: nIt(DAVIDSON) = 1 Energy at sites (6, 7) is -107.199617215047 Stats: nIt(DAVIDSON) = 14 Energy at sites (5, 6) is -107.199617366515 Stats: nIt(DAVIDSON) = 4 Energy at sites (4, 5) is -107.199617391638 Stats: nIt(DAVIDSON) = 5 Energy at sites (3, 4) is -107.199617421103 Stats: nIt(DAVIDSON) = 2 Energy at sites (2, 3) is -107.199617421543 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.199617421543 ****************************************************************** *** Information on left sweep 1 of instruction 0: *** Elapsed wall time = 21.967172 seconds *** |--> S.join = 1.130759 seconds *** |--> S.solve = 13.28923 seconds *** |--> S.split = 2.725294 seconds *** |--> Tensor update = 4.821336 seconds *** |--> create = 0.130893 seconds *** |--> destroy = 0.001649 seconds *** |--> disk write = 0.309763 seconds *** |--> disk read = 0.033507 seconds *** |--> calc = 4.345423 seconds *** Disk write bandwidth = 2.71555639002389 MB/s *** Disk read bandwidth = 24.9964166186357 MB/s *** Minimum energy = -107.199617421543 *** Maximum discarded weight = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (0, 1) is -107.199617421543 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.199617421543 Stats: nIt(DAVIDSON) = 1 Energy at sites (2, 3) is -107.199617421543 Stats: nIt(DAVIDSON) = 1 Energy at sites (3, 4) is -107.199617421543 Stats: nIt(DAVIDSON) = 2 Energy at sites (4, 5) is -107.199617421591 Stats: nIt(DAVIDSON) = 2 Energy at sites (5, 6) is -107.199617421732 Stats: nIt(DAVIDSON) = 2 Energy at sites (6, 7) is -107.1996174219 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -107.199617421899 ****************************************************************** *** Information on right sweep 1 of instruction 0: *** Elapsed wall time = 16.514321 seconds *** |--> S.join = 1.318179 seconds *** |--> S.solve = 7.73335 seconds *** |--> S.split = 2.923978 seconds *** |--> Tensor update = 4.462341 seconds *** |--> create = 0.055758 seconds *** |--> destroy = 0.073776 seconds *** |--> disk write = 0.105277 seconds *** |--> disk read = 0.042472 seconds *** |--> calc = 4.184968 seconds *** Disk write bandwidth = 7.95572567265998 MB/s *** Disk read bandwidth = 19.8054928904447 MB/s *** Minimum energy = -107.1996174219 *** Maximum discarded weight = 0 *** Energy difference with respect to previous leftright sweep = 2.06852490691745e-07 ****************************************************************** *** Information on completed instruction 0: *** The reduced virtual dimension DSU(2) = 500 *** The total number of reduced MPS variables = 2254 *** Minimum energy encountered during all instructions = -107.1996174219 *** Minimum energy encountered during the last sweep = -107.1996174219 *** Maximum discarded weight during the last sweep = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 8 Energy at sites (8, 9) is -107.199617421906 Stats: nIt(DAVIDSON) = 10 Energy at sites (7, 8) is -107.19961742191 Stats: nIt(DAVIDSON) = 16 Energy at sites (6, 7) is -107.199617421914 Stats: nIt(DAVIDSON) = 23 Energy at sites (5, 6) is -107.199617421916 Stats: nIt(DAVIDSON) = 13 Energy at sites (4, 5) is -107.199617421917 Stats: nIt(DAVIDSON) = 13 Energy at sites (3, 4) is -107.199617421918 Stats: nIt(DAVIDSON) = 9 Energy at sites (2, 3) is -107.199617421919 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.199617421919 ****************************************************************** *** Information on left sweep 0 of instruction 1: *** Elapsed wall time = 41.078159 seconds *** |--> S.join = 1.041104 seconds *** |--> S.solve = 32.297129 seconds *** |--> S.split = 2.817235 seconds *** |--> Tensor update = 4.92213 seconds *** |--> create = 0.098194 seconds *** |--> destroy = 0.00158 seconds *** |--> disk write = 0.229875 seconds *** |--> disk read = 0.110133 seconds *** |--> calc = 4.48226 seconds *** Disk write bandwidth = 3.65928828294929 MB/s *** Disk read bandwidth = 7.6049406775501 MB/s *** Minimum energy = -107.199617421919 *** Maximum discarded weight = 0 ****************************************************************** Stats: nIt(DAVIDSON) = 1 Energy at sites (0, 1) is -107.199617421919 Stats: nIt(DAVIDSON) = 1 Energy at sites (1, 2) is -107.199617421919 Stats: nIt(DAVIDSON) = 1 Energy at sites (2, 3) is -107.199617421919 Stats: nIt(DAVIDSON) = 6 Energy at sites (3, 4) is -107.199617421919 Stats: nIt(DAVIDSON) = 8 Energy at sites (4, 5) is -107.199617421919 Stats: nIt(DAVIDSON) = 17 Energy at sites (5, 6) is -107.199617421919 Stats: nIt(DAVIDSON) = 9 Energy at sites (6, 7) is -107.199617421919 Stats: nIt(DAVIDSON) = 1 Energy at sites (7, 8) is -107.199617421919 ****************************************************************** *** Information on right sweep 0 of instruction 1: *** Elapsed wall time = 28.61689 seconds *** |--> S.join = 1.00324 seconds *** |--> S.solve = 17.965883 seconds *** |--> S.split = 2.657525 seconds *** |--> Tensor update = 6.989681 seconds *** |--> create = 0.149331 seconds *** |--> destroy = 0.004364 seconds *** |--> disk write = 2.073827 seconds *** |--> disk read = 0.197659 seconds *** |--> calc = 4.564344 seconds *** Disk write bandwidth = 0.403869238678359 MB/s *** Disk read bandwidth = 4.25570752681623 MB/s *** Minimum energy = -107.199617421919 *** Maximum discarded weight = 0 *** Energy difference with respect to previous leftright sweep = 1.92983407032443e-11 ****************************************************************** *** Information on completed instruction 1: *** The reduced virtual dimension DSU(2) = 1000 *** The total number of reduced MPS variables = 2254 *** Minimum energy encountered during all instructions = -107.199617421919 *** Minimum energy encountered during the last sweep = -107.199617421919 *** Maximum discarded weight during the last sweep = 0 ****************************************************************** ******************************************** *** 2-RDM and Correlations calculation *** ******************************************** N(N-1) = 182 Double trace of DMRG 2-RDM = 182 Econst + 0.5 * trace(2DM-A * Ham) = -107.199617421919 NOON of irrep Ag = [ 1.99998814651064 , 1.98924041565518 , 1.87687858003488 ]. NOON of irrep B2g = [ 0.139387811247081 ]. NOON of irrep B3g = [ 1.03112739700779 ]. NOON of irrep B1u = [ 1.99999431244149 , 1.10839164050188 , 0.0211636956963899 ]. NOON of irrep B2u = [ 1.96715797367127 ]. NOON of irrep B3u = [ 1.86667002723339 ]. Single-orbital entropies (Hamiltonian index order is used!) = [ 0.000149980007850726 , 0.0818410216421183 , 0.449623197859364 , 0.486645055483177 , 0.811029481435732 , 6.6886811744085e-05 , 0.962046613413347 , 0.112095070421304 , 0.167176149973968 , 0.475082461147558 ]. Idistance(0) = 2.38445939059 Idistance(1) = 9.57998273356264 Idistance(2) = 47.8783646553703 *************************************************** *** Timing information 2-RDM and Correlations *** *************************************************** *** Elapsed wall time = 20.528238 seconds *** |--> MPS gauge change = 6.209172 seconds *** |--> Diagram calc = 1.295301 seconds *** |--> Tensor update = 13.022642 seconds *** |--> create = 0.245164 seconds *** |--> destroy = 0.023411 seconds *** |--> disk write = 1.413795 seconds *** |--> disk read = 0.721063 seconds *** |--> calc = 10.618834 seconds *** Disk write bandwidth = 1.20643398059113 MB/s *** Disk read bandwidth = 2.36546644272393 MB/s *************************************************** FCI::Startup : Number of variables in the FCI vector = 1182 FCI::Startup : Without additional loops the FCI matrix-vector product requires a workspace of 0.06982421875 MB memory. FCI::matvec : Wall time = 309.472996 seconds FCI::matvec : Wall time = 306.43962 seconds FCI::matvec : Wall time = 325.163157 seconds FCI::matvec : Wall time = 310.798106 seconds FCI::matvec : Wall time = 315.532011 seconds FCI::matvec : Wall time = 326.873921 seconds FCI::matvec : Wall time = 326.11103 seconds FCI::matvec : Wall time = 317.581292 seconds FCI::matvec : Wall time = 321.715561 seconds FCI::matvec : Wall time = 314.806597 seconds FCI::matvec : Wall time = 314.213601 seconds FCI::matvec : Wall time = 315.998949 seconds FCI::matvec : Wall time = 324.59139 seconds FCI::matvec : Wall time = 323.211459 seconds FCI::matvec : Wall time = 310.39769 seconds FCI::matvec : Wall time = 303.668077 seconds FCI::matvec : Wall time = 304.302066 seconds FCI::matvec : Wall time = 303.097761 seconds FCI::matvec : Wall time = 303.442798 seconds FCI::matvec : Wall time = 304.127043 seconds FCI::matvec : Wall time = 308.275109 seconds FCI::GSDavidson : Converged ground state energy = -107.199617421919 FCI::CalcSpinSquared : For intended spin 1 the measured S(S+1) = 2 and intended S(S+1) = 2 Info on DMRG::operators rm call to system: 0 RMS difference FCI and DMRG determinant coefficients = 0.0 RMS difference FCI and DMRG determinant coefficients = 0.0 RMS difference FCI and DMRG determinant coefficients = 0.0 RMS difference FCI and DMRG determinant coefficients = 0.0 RMS difference FCI and DMRG determinant coefficients = 0.0 RMS difference FCI and DMRG determinant coefficients = 0.0 ================> Did test 1 succeed : yes make[1]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10' create-stamp debian/debhelper-build-stamp fakeroot debian/rules binary-arch dh binary-arch --with python3 dh_testroot -a dh_prep -a debian/rules override_dh_auto_install make[1]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10' dh_auto_install cd obj-x86_64-linux-gnu && make -j4 install DESTDIR=/build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp AM_UPDATE_INFO_DIR=no "INSTALL=install --strip-program=true" make[2]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[3]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 65%] Built target chemps2-base make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 66%] Built target chemps2-static [ 67%] Built target chemps2-shared make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 69%] Built target test3 [ 71%] Built target test1 make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 73%] Built target chemps2-bin make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 76%] Built target test12 [ 78%] Built target test14 make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 80%] Built target test6 make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 82%] Built target test4 make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 84%] Built target test7 make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 86%] Built target test2 make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 89%] Built target test8 make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 91%] Built target test5 [ 93%] Built target test13 make[4]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 95%] Built target test9 make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' make[4]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' [ 97%] Built target test10 [100%] Built target test11 make[3]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' Install the project... -- Install configuration: "release" -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/share/cmake/CheMPS2/CheMPS2Config.cmake -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/share/cmake/CheMPS2/CheMPS2ConfigVersion.cmake -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/share/cmake/CheMPS2/FindTargetHDF5.cmake -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/lib/x86_64-linux-gnu/libchemps2.so.3 -- Set runtime path of "/build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/lib/x86_64-linux-gnu/libchemps2.so.3" to "" -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/lib/x86_64-linux-gnu/libchemps2.so -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/bin/chemps2 -- Set runtime path of "/build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/bin/chemps2" to "" -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/lib/x86_64-linux-gnu/libchemps2.a -- Up-to-date: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/bin/chemps2 -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2 -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/Irreps.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/FourIndex.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/MPIchemps2.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/Heff.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/TensorQ.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/EdmistonRuedenberg.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/SyBookkeeper.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/DIIS.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/FCI.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/TensorKM.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/ConvergenceScheme.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/TensorT.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/DMRGSCFmatrix.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/TwoIndex.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/Correlations.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/Problem.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/TensorS0.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/Excitation.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/DMRGSCFintegrals.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/TensorX.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/TensorS1.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/TensorF0.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/DMRG.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/DMRGSCFunitary.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/Special.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/Tensor3RDM.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/Tensor.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/TensorO.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/ThreeDM.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/DMRGSCFoptions.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/Wigner.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/Cumulant.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/Molden.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/TensorOperator.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/CASSCF.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/ConjugateGradient.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/TensorGYZ.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/Hamiltonian.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/Initialize.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/TwoDM.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/Options.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/Davidson.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/Sobject.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/DMRGSCFindices.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/CASPT2.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/TensorL.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/DMRGSCFrotations.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/TensorF1.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/Lapack.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/include/chemps2/DMRGSCFwtilde.h -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/share/cmake/CheMPS2/CheMPS2Targets-shared.cmake -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/share/cmake/CheMPS2/CheMPS2Targets-shared-release.cmake -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/share/cmake/CheMPS2/CheMPS2Targets-static.cmake -- Installing: /build/chemps2-kynhKE/chemps2-1.8.10/debian/tmp/usr/share/cmake/CheMPS2/CheMPS2Targets-static-release.cmake make[2]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10/obj-x86_64-linux-gnu' # This will skip the build as it is already performed cd PyCheMPS2 && CPATH=../CheMPS2/include:/usr/include/hdf5/serial python3 setup.py install --root=../debian/tmp --install-layout=deb running install running build running build_ext skipping 'PyCheMPS2.cpp' Cython extension (up-to-date) running install_lib creating ../debian/tmp/usr/lib/python3 creating ../debian/tmp/usr/lib/python3/dist-packages copying build/lib.linux-x86_64-3.9/PyCheMPS2.cpython-39-x86_64-linux-gnu.so -> ../debian/tmp/usr/lib/python3/dist-packages running install_egg_info Writing ../debian/tmp/usr/lib/python3/dist-packages/CheMPS2-1.8.10.egg-info dh_numpy3 make[1]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10' dh_install -a dh_installdocs -a debian/rules override_dh_installchangelogs make[1]: Entering directory '/build/chemps2-kynhKE/chemps2-1.8.10' dh_installchangelogs -k CHANGELOG.md make[1]: Leaving directory '/build/chemps2-kynhKE/chemps2-1.8.10' dh_installman -a dh_python3 -a dh_perl -a dh_link -a dh_strip_nondeterminism -a dh_compress -a dh_fixperms -a dh_missing -a dh_strip -a dh_makeshlibs -a dpkg-gensymbols: warning: some new symbols appeared in the symbols file: see diff output below dpkg-gensymbols: warning: debian/libchemps2-3/DEBIAN/symbols doesn't match completely debian/libchemps2-3.symbols --- debian/libchemps2-3.symbols (libchemps2-3_1.8.10-2_amd64) +++ dpkg-gensymbolsqReNKO 2021-10-12 15:39:41.208322802 +0000 @@ -160,6 +160,7 @@ _ZN7CheMPS216DMRGSCFrotations6rotateEPKNS_9FourIndexEPS1_PNS_16DMRGSCFintegralsEccccPNS_14DMRGSCFindicesEPNS_14DMRGSCFunitaryEPdSB_iNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEE@Base 1.8.7 _ZN7CheMPS216DMRGSCFrotations9dimensionEPNS_14DMRGSCFindicesEic@Base 1.8.7 #MISSING: 1.8.10-2# (optional)_ZN7CheMPS216DMRGSCFrotations9open_fileEPiS1_S1_iiNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEE@Base 1.8.7 + _ZN7CheMPS216DMRGSCFrotations9open_fileEPlS1_S1_iiNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEE@Base 1.8.10-2 #MISSING: 1.8.10-2# (optional)_ZN7CheMPS216DMRGSCFrotations9open_fileEPxS1_S1_iiNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEE@Base 1.8.7 #MISSING: 1.8.10-2# (optional)_ZN7CheMPS216DMRGSCFrotations9read_fileEiiPdiii@Base 1.8.7 (optional)_ZN7CheMPS216DMRGSCFrotations9read_fileEllPdiii@Base 1.8.7 dh_shlibdeps -a dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/python3-chemps2/usr/lib/python3/dist-packages/PyCheMPS2.cpython-39-x86_64-linux-gnu.so was not linked against libpthread.so.0 (it uses none of the library's symbols) dh_installdeb -a dh_gencontrol -a dpkg-gencontrol: warning: package python3-chemps2: substitution variable ${python3:Provides} unused, but is defined dpkg-gencontrol: warning: package python3-chemps2: substitution variable ${python3:Versions} unused, but is defined dpkg-gencontrol: warning: Depends field of package libchemps2-dev: substitution variable ${shlibs:Depends} used, but is not defined dpkg-gencontrol: warning: package chemps2: substitution variable ${python3:Depends} unused, but is defined dpkg-gencontrol: warning: package libchemps2-3: substitution variable ${python3:Depends} unused, but is defined dpkg-gencontrol: warning: package libchemps2-dev: substitution variable ${python3:Depends} unused, but is defined dpkg-gencontrol: warning: package python3-chemps2: substitution variable ${python3:Provides} unused, but is defined dpkg-gencontrol: warning: package python3-chemps2: substitution variable ${python3:Versions} unused, but is defined dpkg-gencontrol: warning: package libchemps2-3: substitution variable ${python3:Depends} unused, but is defined dpkg-gencontrol: warning: package chemps2: substitution variable ${python3:Depends} unused, but is defined dh_md5sums -a dh_builddeb -a dpkg-deb: building package 'libchemps2-dev' in '../libchemps2-dev_1.8.10-2_amd64.deb'. dpkg-deb: building package 'chemps2-dbgsym' in '../chemps2-dbgsym_1.8.10-2_amd64.deb'. dpkg-deb: building package 'libchemps2-3' in '../libchemps2-3_1.8.10-2_amd64.deb'. dpkg-deb: building package 'python3-chemps2-dbgsym' in '../python3-chemps2-dbgsym_1.8.10-2_amd64.deb'. dpkg-deb: building package 'python3-chemps2' in '../python3-chemps2_1.8.10-2_amd64.deb'. dpkg-deb: building package 'chemps2' in '../chemps2_1.8.10-2_amd64.deb'. dpkg-deb: building package 'libchemps2-3-dbgsym' in '../libchemps2-3-dbgsym_1.8.10-2_amd64.deb'. dpkg-genbuildinfo --build=any dpkg-genchanges --build=any >../chemps2_1.8.10-2_amd64.changes dpkg-genchanges: info: binary-only arch-specific upload (source code and arch-indep packages not included) dpkg-source --after-build . dpkg-buildpackage: info: binary-only upload (no source included) I: running special hook: sync-out /build/chemps2-kynhKE /tmp/chemps2-1.8.10-2em2paxw6 I: cleaning package lists and apt cache... I: creating tarball... I: done I: removing tempdir /tmp/mmdebstrap.O3ldCIq2IX... I: success in 40453.8681 seconds md5: chemps2-dbgsym_1.8.10-2_amd64.deb: OK md5: chemps2_1.8.10-2_amd64.deb: OK md5: libchemps2-3-dbgsym_1.8.10-2_amd64.deb: OK md5: libchemps2-3_1.8.10-2_amd64.deb: OK md5: libchemps2-dev_1.8.10-2_amd64.deb: OK md5: python3-chemps2-dbgsym_1.8.10-2_amd64.deb: OK md5: python3-chemps2_1.8.10-2_amd64.deb: OK sha1: chemps2-dbgsym_1.8.10-2_amd64.deb: OK sha1: chemps2_1.8.10-2_amd64.deb: OK sha1: libchemps2-3-dbgsym_1.8.10-2_amd64.deb: OK sha1: libchemps2-3_1.8.10-2_amd64.deb: OK sha1: libchemps2-dev_1.8.10-2_amd64.deb: OK sha1: python3-chemps2-dbgsym_1.8.10-2_amd64.deb: OK sha1: python3-chemps2_1.8.10-2_amd64.deb: OK sha256: chemps2-dbgsym_1.8.10-2_amd64.deb: OK sha256: chemps2_1.8.10-2_amd64.deb: OK sha256: libchemps2-3-dbgsym_1.8.10-2_amd64.deb: OK sha256: libchemps2-3_1.8.10-2_amd64.deb: OK sha256: libchemps2-dev_1.8.10-2_amd64.deb: OK sha256: python3-chemps2-dbgsym_1.8.10-2_amd64.deb: OK sha256: python3-chemps2_1.8.10-2_amd64.deb: OK Checksums: OK