Sat Mar 22 07:18:03 UTC 2025 I: starting to build chemps2/trixie/i386 on jenkins on '2025-03-22 07:17'
Sat Mar 22 07:18:03 UTC 2025 I: The jenkins build log is/was available at https://jenkins.debian.net/userContent/reproducible/debian/build_service/i386_2/61219/console.log
Sat Mar 22 07:18:03 UTC 2025 I: Downloading source for trixie/chemps2=1.8.12-4
--2025-03-22 07:18:03-- http://deb.debian.org/debian/pool/main/c/chemps2/chemps2_1.8.12-4.dsc
Connecting to 46.16.76.132:3128... connected.
Proxy request sent, awaiting response... 200 OK
Length: 2570 (2.5K) [text/prs.lines.tag]
Saving to: ‘chemps2_1.8.12-4.dsc’
0K .. 100% 368M=0s
2025-03-22 07:18:03 (368 MB/s) - ‘chemps2_1.8.12-4.dsc’ saved [2570/2570]
Sat Mar 22 07:18:03 UTC 2025 I: chemps2_1.8.12-4.dsc
-----BEGIN PGP SIGNED MESSAGE-----
Hash: SHA256
Format: 3.0 (quilt)
Source: chemps2
Binary: libchemps2-3t64, libchemps2-dev, chemps2-doc, chemps2, python3-chemps2
Architecture: any all
Version: 1.8.12-4
Maintainer: Debichem Team <debichem-devel@lists.alioth.debian.org>
Uploaders: Sebastian Wouters <sebastianwouters@gmail.com>, Michael Banck <mbanck@debian.org>
Homepage: https://sebwouters.github.io/CheMPS2/index.html
Standards-Version: 4.6.2
Vcs-Browser: https://salsa.debian.org/debichem-team/chemps2
Vcs-Git: https://salsa.debian.org/debichem-team/chemps2.git
Testsuite: autopkgtest
Testsuite-Triggers: cmake, g++, libhdf5-dev, python3-all, python3-numpy
Build-Depends: dpkg-dev (>= 1.22.5), debhelper-compat (= 13), cmake, cython3, libblas-dev, liblapack-dev, libhdf5-dev, dh-sequence-python3, python3-all, python3-setuptools, python3-docutils, python3-numpy, libpython3-dev
Build-Depends-Indep: python3-sphinx, libjs-mathjax, libjs-jquery, libjs-underscore
Package-List:
chemps2 deb science optional arch=any
chemps2-doc deb doc optional arch=all
libchemps2-3t64 deb libs optional arch=any
libchemps2-dev deb libdevel optional arch=any
python3-chemps2 deb python optional arch=any
Checksums-Sha1:
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cbc5985c89d9ff903693c066ad6072dd614fc984 15440 chemps2_1.8.12-4.debian.tar.xz
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eef1b92d74ac07fde58c043f64e8cac02b5400c209c44dcbb51641f86e0c7c83 1250047 chemps2_1.8.12.orig.tar.gz
871376f92f7b8125646529f6a02aacd69629967b4a44e86c11503d08c4d73f51 15440 chemps2_1.8.12-4.debian.tar.xz
Files:
66811448c478d39cc3407a972bd958a0 1250047 chemps2_1.8.12.orig.tar.gz
e4863f64e1d506289af7b87e69c6e156 15440 chemps2_1.8.12-4.debian.tar.xz
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Sat Mar 22 07:18:03 UTC 2025 I: Checking whether the package is not for us
Sat Mar 22 07:18:03 UTC 2025 I: Starting 1st build on remote node ionos6-i386.debian.net.
Sat Mar 22 07:18:03 UTC 2025 I: Preparing to do remote build '1' on ionos6-i386.debian.net.
Sat Mar 22 07:20:24 UTC 2025 I: Deleting $TMPDIR on ionos6-i386.debian.net.
I: pbuilder: network access will be disabled during build
I: Current time: Fri Apr 24 01:41:04 -12 2026
I: pbuilder-time-stamp: 1777038064
I: Building the build Environment
I: extracting base tarball [/var/cache/pbuilder/trixie-reproducible-base.tgz]
I: copying local configuration
W: --override-config is not set; not updating apt.conf Read the manpage for details.
I: mounting /proc filesystem
I: mounting /sys filesystem
I: creating /{dev,run}/shm
I: mounting /dev/pts filesystem
I: redirecting /dev/ptmx to /dev/pts/ptmx
I: policy-rc.d already exists
I: using eatmydata during job
I: Copying source file
I: copying [chemps2_1.8.12-4.dsc]
I: copying [./chemps2_1.8.12.orig.tar.gz]
I: copying [./chemps2_1.8.12-4.debian.tar.xz]
I: Extracting source
dpkg-source: warning: cannot verify inline signature for ./chemps2_1.8.12-4.dsc: unsupported subcommand
dpkg-source: info: extracting chemps2 in chemps2-1.8.12
dpkg-source: info: unpacking chemps2_1.8.12.orig.tar.gz
dpkg-source: info: unpacking chemps2_1.8.12-4.debian.tar.xz
I: Not using root during the build.
I: Installing the build-deps
I: user script /srv/workspace/pbuilder/123616/tmp/hooks/D02_print_environment starting
I: set
BUILDDIR='/build/reproducible-path'
BUILDUSERGECOS='first user,first room,first work-phone,first home-phone,first other'
BUILDUSERNAME='pbuilder1'
BUILD_ARCH='i386'
DEBIAN_FRONTEND='noninteractive'
DEB_BUILD_OPTIONS='buildinfo=+all reproducible=+all parallel=22 '
DISTRIBUTION='trixie'
HOME='/root'
HOST_ARCH='i386'
IFS='
'
INVOCATION_ID='bc2336edcc8946c7bcc1990dd066eec4'
LANG='C'
LANGUAGE='en_US:en'
LC_ALL='C'
LD_LIBRARY_PATH='/usr/lib/libeatmydata'
LD_PRELOAD='libeatmydata.so'
MAIL='/var/mail/root'
OPTIND='1'
PATH='/usr/sbin:/usr/bin:/sbin:/bin:/usr/games'
PBCURRENTCOMMANDLINEOPERATION='build'
PBUILDER_OPERATION='build'
PBUILDER_PKGDATADIR='/usr/share/pbuilder'
PBUILDER_PKGLIBDIR='/usr/lib/pbuilder'
PBUILDER_SYSCONFDIR='/etc'
PPID='123616'
PS1='# '
PS2='> '
PS4='+ '
PWD='/'
SHELL='/bin/bash'
SHLVL='2'
SUDO_COMMAND='/usr/bin/timeout -k 18.1h 18h /usr/bin/ionice -c 3 /usr/bin/nice /usr/sbin/pbuilder --build --configfile /srv/reproducible-results/rbuild-debian/r-b-build.DWpQvwU9/pbuilderrc_74pX --distribution trixie --hookdir /etc/pbuilder/first-build-hooks --debbuildopts -b --basetgz /var/cache/pbuilder/trixie-reproducible-base.tgz --buildresult /srv/reproducible-results/rbuild-debian/r-b-build.DWpQvwU9/b1 --logfile b1/build.log chemps2_1.8.12-4.dsc'
SUDO_GID='112'
SUDO_UID='107'
SUDO_USER='jenkins'
TERM='unknown'
TZ='/usr/share/zoneinfo/Etc/GMT+12'
USER='root'
_='/usr/bin/systemd-run'
http_proxy='http://213.165.73.152:3128'
I: uname -a
Linux ionos6-i386 6.1.0-32-amd64 #1 SMP PREEMPT_DYNAMIC Debian 6.1.129-1 (2025-03-06) x86_64 GNU/Linux
I: ls -l /bin
lrwxrwxrwx 1 root root 7 Mar 4 2025 /bin -> usr/bin
I: user script /srv/workspace/pbuilder/123616/tmp/hooks/D02_print_environment finished
-> Attempting to satisfy build-dependencies
-> Creating pbuilder-satisfydepends-dummy package
Package: pbuilder-satisfydepends-dummy
Version: 0.invalid.0
Architecture: i386
Maintainer: Debian Pbuilder Team <pbuilder-maint@lists.alioth.debian.org>
Description: Dummy package to satisfy dependencies with aptitude - created by pbuilder
This package was created automatically by pbuilder to satisfy the
build-dependencies of the package being currently built.
Depends: dpkg-dev (>= 1.22.5), debhelper-compat (= 13), cmake, cython3, libblas-dev, liblapack-dev, libhdf5-dev, dh-sequence-python3, python3-all, python3-setuptools, python3-docutils, python3-numpy, libpython3-dev, python3-sphinx, libjs-mathjax, libjs-jquery, libjs-underscore
dpkg-deb: building package 'pbuilder-satisfydepends-dummy' in '/tmp/satisfydepends-aptitude/pbuilder-satisfydepends-dummy.deb'.
Selecting previously unselected package pbuilder-satisfydepends-dummy.
(Reading database ... 19771 files and directories currently installed.)
Preparing to unpack .../pbuilder-satisfydepends-dummy.deb ...
Unpacking pbuilder-satisfydepends-dummy (0.invalid.0) ...
dpkg: pbuilder-satisfydepends-dummy: dependency problems, but configuring anyway as you requested:
pbuilder-satisfydepends-dummy depends on debhelper-compat (= 13); however:
Package debhelper-compat is not installed.
pbuilder-satisfydepends-dummy depends on cmake; however:
Package cmake is not installed.
pbuilder-satisfydepends-dummy depends on cython3; however:
Package cython3 is not installed.
pbuilder-satisfydepends-dummy depends on libblas-dev; however:
Package libblas-dev is not installed.
pbuilder-satisfydepends-dummy depends on liblapack-dev; however:
Package liblapack-dev is not installed.
pbuilder-satisfydepends-dummy depends on libhdf5-dev; however:
Package libhdf5-dev is not installed.
pbuilder-satisfydepends-dummy depends on dh-sequence-python3; however:
Package dh-sequence-python3 is not installed.
pbuilder-satisfydepends-dummy depends on python3-all; however:
Package python3-all is not installed.
pbuilder-satisfydepends-dummy depends on python3-setuptools; however:
Package python3-setuptools is not installed.
pbuilder-satisfydepends-dummy depends on python3-docutils; however:
Package python3-docutils is not installed.
pbuilder-satisfydepends-dummy depends on python3-numpy; however:
Package python3-numpy is not installed.
pbuilder-satisfydepends-dummy depends on libpython3-dev; however:
Package libpython3-dev is not installed.
pbuilder-satisfydepends-dummy depends on python3-sphinx; however:
Package python3-sphinx is not installed.
pbuilder-satisfydepends-dummy depends on libjs-mathjax; however:
Package libjs-mathjax is not installed.
pbuilder-satisfydepends-dummy depends on libjs-jquery; however:
Package libjs-jquery is not installed.
pbuilder-satisfydepends-dummy depends on libjs-underscore; however:
Package libjs-underscore is not installed.
Setting up pbuilder-satisfydepends-dummy (0.invalid.0) ...
Reading package lists...
Building dependency tree...
Reading state information...
Initializing package states...
Writing extended state information...
Building tag database...
pbuilder-satisfydepends-dummy is already installed at the requested version (0.invalid.0)
pbuilder-satisfydepends-dummy is already installed at the requested version (0.invalid.0)
The following NEW packages will be installed:
autoconf{a} automake{a} autopoint{a} autotools-dev{a} bsdextrautils{a} ca-certificates{a} cmake{a} cmake-data{a} comerr-dev{a} cython3{a} debhelper{a} dh-autoreconf{a} dh-python{a} dh-strip-nondeterminism{a} docutils-common{a} dwz{a} file{a} fonts-mathjax{a} gettext{a} gettext-base{a} groff-base{a} hdf5-helpers{a} intltool-debian{a} krb5-multidev{a} libaec-dev{a} libaec0{a} libarchive-zip-perl{a} libarchive13t64{a} libblas-dev{a} libblas3{a} libbrotli-dev{a} libbrotli1{a} libcom-err2{a} libcurl4-openssl-dev{a} libcurl4t64{a} libdebhelper-perl{a} libelf1t64{a} libevent-2.1-7t64{a} libexpat1{a} libexpat1-dev{a} libffi8{a} libfile-stripnondeterminism-perl{a} libgfortran5{a} libgmp-dev{a} libgmpxx4ldbl{a} libgnutls-dane0t64{a} libgnutls-openssl27t64{a} libgnutls28-dev{a} libgnutls30t64{a} libgssapi-krb5-2{a} libgssrpc4t64{a} libhdf5-310{a} libhdf5-cpp-310{a} libhdf5-dev{a} libhdf5-fortran-310{a} libhdf5-hl-310{a} libhdf5-hl-cpp-310{a} libhdf5-hl-fortran-310{a} libicu72{a} libidn2-0{a} libidn2-dev{a} libjpeg-dev{a} libjpeg62-turbo{a} libjpeg62-turbo-dev{a} libjs-jquery{a} libjs-mathjax{a} libjs-sphinxdoc{a} libjs-underscore{a} libjson-perl{a} libjsoncpp26{a} libk5crypto3{a} libkadm5clnt-mit12{a} libkadm5srv-mit12{a} libkdb5-10t64{a} libkeyutils1{a} libkrb5-3{a} libkrb5-dev{a} libkrb5support0{a} liblapack-dev{a} liblapack3{a} libldap-dev{a} libldap2{a} libmagic-mgc{a} libmagic1t64{a} libnghttp2-14{a} libnghttp2-dev{a} libnghttp3-9{a} libnghttp3-dev{a} libp11-kit-dev{a} libp11-kit0{a} libpipeline1{a} libpkgconf3{a} libproc2-0{a} libpsl-dev{a} libpsl5t64{a} libpython3-dev{a} libpython3-stdlib{a} libpython3.13{a} libpython3.13-dev{a} libpython3.13-minimal{a} libpython3.13-stdlib{a} libreadline8t64{a} librhash1{a} librtmp-dev{a} librtmp1{a} libsasl2-2{a} libsasl2-modules-db{a} libssh2-1-dev{a} libssh2-1t64{a} libssl-dev{a} libsz2{a} libtasn1-6{a} libtasn1-6-dev{a} libtool{a} libuchardet0{a} libunbound8{a} libunistring5{a} libuv1t64{a} libxml2{a} libzstd-dev{a} m4{a} man-db{a} media-types{a} netbase{a} nettle-dev{a} openssl{a} pkgconf{a} pkgconf-bin{a} po-debconf{a} procps{a} python-babel-localedata{a} python3{a} python3-alabaster{a} python3-all{a} python3-autocommand{a} python3-babel{a} python3-certifi{a} python3-chardet{a} python3-charset-normalizer{a} python3-defusedxml{a} python3-docutils{a} python3-idna{a} python3-imagesize{a} python3-inflect{a} python3-jaraco.context{a} python3-jaraco.functools{a} python3-jaraco.text{a} python3-jinja2{a} python3-markupsafe{a} python3-minimal{a} python3-more-itertools{a} python3-numpy{a} python3-numpy-dev{a} python3-packaging{a} python3-pkg-resources{a} python3-pygments{a} python3-requests{a} python3-roman{a} python3-setuptools{a} python3-snowballstemmer{a} python3-sphinx{a} python3-typeguard{a} python3-typing-extensions{a} python3-urllib3{a} python3-zipp{a} python3.13{a} python3.13-minimal{a} readline-common{a} sensible-utils{a} sgml-base{a} sphinx-common{a} tzdata{a} xml-core{a} zlib1g-dev{a}
The following packages are RECOMMENDED but will NOT be installed:
curl javascript-common krb5-locales libarchive-cpio-perl libjson-xs-perl libldap-common libltdl-dev libmail-sendmail-perl libpaper-utils libsasl2-modules libtasn1-doc linux-sysctl-defaults lynx psmisc publicsuffix python3-dev python3-pil wget
0 packages upgraded, 174 newly installed, 0 to remove and 0 not upgraded.
Need to get 111 MB of archives. After unpacking 449 MB will be used.
Writing extended state information...
Get: 1 http://deb.debian.org/debian trixie/main i386 libpython3.13-minimal i386 3.13.2-2 [859 kB]
Get: 2 http://deb.debian.org/debian trixie/main i386 libexpat1 i386 2.6.4-1 [107 kB]
Get: 3 http://deb.debian.org/debian trixie/main i386 python3.13-minimal i386 3.13.2-2 [2262 kB]
Get: 4 http://deb.debian.org/debian trixie/main i386 python3-minimal i386 3.13.2-2 [27.1 kB]
Get: 5 http://deb.debian.org/debian trixie/main i386 media-types all 13.0.0 [29.3 kB]
Get: 6 http://deb.debian.org/debian trixie/main i386 netbase all 6.5 [12.4 kB]
Get: 7 http://deb.debian.org/debian trixie/main i386 tzdata all 2025a-2 [259 kB]
Get: 8 http://deb.debian.org/debian trixie/main i386 libffi8 i386 3.4.7-1 [21.4 kB]
Get: 9 http://deb.debian.org/debian trixie/main i386 readline-common all 8.2-6 [69.4 kB]
Get: 10 http://deb.debian.org/debian trixie/main i386 libreadline8t64 i386 8.2-6 [173 kB]
Get: 11 http://deb.debian.org/debian trixie/main i386 libpython3.13-stdlib i386 3.13.2-2 [1960 kB]
Get: 12 http://deb.debian.org/debian trixie/main i386 python3.13 i386 3.13.2-2 [746 kB]
Get: 13 http://deb.debian.org/debian trixie/main i386 libpython3-stdlib i386 3.13.2-2 [10.1 kB]
Get: 14 http://deb.debian.org/debian trixie/main i386 python3 i386 3.13.2-2 [28.1 kB]
Get: 15 http://deb.debian.org/debian trixie/main i386 python3-numpy-dev i386 1:2.2.3+ds-5 [146 kB]
Get: 16 http://deb.debian.org/debian trixie/main i386 libblas3 i386 3.12.1-2 [150 kB]
Get: 17 http://deb.debian.org/debian trixie/main i386 libgfortran5 i386 14.2.0-17 [735 kB]
Get: 18 http://deb.debian.org/debian trixie/main i386 liblapack3 i386 3.12.1-2 [2198 kB]
Get: 19 http://deb.debian.org/debian trixie/main i386 python3-numpy i386 1:2.2.3+ds-5 [5060 kB]
Get: 20 http://deb.debian.org/debian trixie/main i386 sgml-base all 1.31 [15.4 kB]
Get: 21 http://deb.debian.org/debian trixie/main i386 libproc2-0 i386 2:4.0.4-7 [66.0 kB]
Get: 22 http://deb.debian.org/debian trixie/main i386 procps i386 2:4.0.4-7 [876 kB]
Get: 23 http://deb.debian.org/debian trixie/main i386 sensible-utils all 0.0.24 [24.8 kB]
Get: 24 http://deb.debian.org/debian trixie/main i386 openssl i386 3.4.1-1 [1432 kB]
Get: 25 http://deb.debian.org/debian trixie/main i386 ca-certificates all 20241223 [164 kB]
Get: 26 http://deb.debian.org/debian trixie/main i386 libmagic-mgc i386 1:5.45-3+b1 [314 kB]
Get: 27 http://deb.debian.org/debian trixie/main i386 libmagic1t64 i386 1:5.45-3+b1 [115 kB]
Get: 28 http://deb.debian.org/debian trixie/main i386 file i386 1:5.45-3+b1 [43.2 kB]
Get: 29 http://deb.debian.org/debian trixie/main i386 gettext-base i386 0.23.1-1 [245 kB]
Get: 30 http://deb.debian.org/debian trixie/main i386 libuchardet0 i386 0.0.8-1+b2 [69.2 kB]
Get: 31 http://deb.debian.org/debian trixie/main i386 groff-base i386 1.23.0-7 [1199 kB]
Get: 32 http://deb.debian.org/debian trixie/main i386 bsdextrautils i386 2.40.4-5 [96.5 kB]
Get: 33 http://deb.debian.org/debian trixie/main i386 libpipeline1 i386 1.5.8-1 [41.2 kB]
Get: 34 http://deb.debian.org/debian trixie/main i386 man-db i386 2.13.0-1 [1428 kB]
Get: 35 http://deb.debian.org/debian trixie/main i386 m4 i386 1.4.19-7 [301 kB]
Get: 36 http://deb.debian.org/debian trixie/main i386 autoconf all 2.72-3 [493 kB]
Get: 37 http://deb.debian.org/debian trixie/main i386 autotools-dev all 20220109.1 [51.6 kB]
Get: 38 http://deb.debian.org/debian trixie/main i386 automake all 1:1.17-3 [862 kB]
Get: 39 http://deb.debian.org/debian trixie/main i386 autopoint all 0.23.1-1 [770 kB]
Get: 40 http://deb.debian.org/debian trixie/main i386 cmake-data all 3.31.6-1 [2268 kB]
Get: 41 http://deb.debian.org/debian trixie/main i386 libicu72 i386 72.1-6 [9582 kB]
Get: 42 http://deb.debian.org/debian trixie/main i386 libxml2 i386 2.12.7+dfsg+really2.9.14-0.2+b2 [734 kB]
Get: 43 http://deb.debian.org/debian trixie/main i386 libarchive13t64 i386 3.7.4-1.1 [390 kB]
Get: 44 http://deb.debian.org/debian trixie/main i386 libbrotli1 i386 1.1.0-2+b7 [299 kB]
Get: 45 http://deb.debian.org/debian trixie/main i386 libkrb5support0 i386 1.21.3-5 [35.3 kB]
Get: 46 http://deb.debian.org/debian trixie/main i386 libcom-err2 i386 1.47.2-1 [24.3 kB]
Get: 47 http://deb.debian.org/debian trixie/main i386 libk5crypto3 i386 1.21.3-5 [84.3 kB]
Get: 48 http://deb.debian.org/debian trixie/main i386 libkeyutils1 i386 1.6.3-4 [9600 B]
Get: 49 http://deb.debian.org/debian trixie/main i386 libkrb5-3 i386 1.21.3-5 [355 kB]
Get: 50 http://deb.debian.org/debian trixie/main i386 libgssapi-krb5-2 i386 1.21.3-5 [149 kB]
Get: 51 http://deb.debian.org/debian trixie/main i386 libunistring5 i386 1.3-1 [458 kB]
Get: 52 http://deb.debian.org/debian trixie/main i386 libidn2-0 i386 2.3.8-2 [110 kB]
Get: 53 http://deb.debian.org/debian trixie/main i386 libsasl2-modules-db i386 2.1.28+dfsg1-9 [20.8 kB]
Get: 54 http://deb.debian.org/debian trixie/main i386 libsasl2-2 i386 2.1.28+dfsg1-9 [61.2 kB]
Get: 55 http://deb.debian.org/debian trixie/main i386 libldap2 i386 2.6.9+dfsg-2 [206 kB]
Get: 56 http://deb.debian.org/debian trixie/main i386 libnghttp2-14 i386 1.64.0-1 [82.4 kB]
Get: 57 http://deb.debian.org/debian trixie/main i386 libnghttp3-9 i386 1.8.0-1 [78.7 kB]
Get: 58 http://deb.debian.org/debian trixie/main i386 libpsl5t64 i386 0.21.2-1.1+b1 [57.7 kB]
Get: 59 http://deb.debian.org/debian trixie/main i386 libp11-kit0 i386 0.25.5-3 [423 kB]
Get: 60 http://deb.debian.org/debian trixie/main i386 libtasn1-6 i386 4.20.0-2 [51.6 kB]
Get: 61 http://deb.debian.org/debian trixie/main i386 libgnutls30t64 i386 3.8.9-2 [1462 kB]
Get: 62 http://deb.debian.org/debian trixie/main i386 librtmp1 i386 2.4+20151223.gitfa8646d.1-2+b5 [62.4 kB]
Get: 63 http://deb.debian.org/debian trixie/main i386 libssh2-1t64 i386 1.11.1-1 [256 kB]
Get: 64 http://deb.debian.org/debian trixie/main i386 libcurl4t64 i386 8.13.0~rc2-1 [426 kB]
Get: 65 http://deb.debian.org/debian trixie/main i386 libjsoncpp26 i386 1.9.6-3 [90.0 kB]
Get: 66 http://deb.debian.org/debian trixie/main i386 librhash1 i386 1.4.5-1 [144 kB]
Get: 67 http://deb.debian.org/debian trixie/main i386 libuv1t64 i386 1.50.0-2 [163 kB]
Get: 68 http://deb.debian.org/debian trixie/main i386 cmake i386 3.31.6-1 [13.1 MB]
Get: 69 http://deb.debian.org/debian trixie/main i386 comerr-dev i386 2.1-1.47.2-1 [56.2 kB]
Get: 70 http://deb.debian.org/debian trixie/main i386 cython3 i386 3.0.11+dfsg-2+b1 [2467 kB]
Get: 71 http://deb.debian.org/debian trixie/main i386 libdebhelper-perl all 13.24.1 [90.9 kB]
Get: 72 http://deb.debian.org/debian trixie/main i386 libtool all 2.5.4-4 [539 kB]
Get: 73 http://deb.debian.org/debian trixie/main i386 dh-autoreconf all 20 [17.1 kB]
Get: 74 http://deb.debian.org/debian trixie/main i386 libarchive-zip-perl all 1.68-1 [104 kB]
Get: 75 http://deb.debian.org/debian trixie/main i386 libfile-stripnondeterminism-perl all 1.14.1-2 [19.7 kB]
Get: 76 http://deb.debian.org/debian trixie/main i386 dh-strip-nondeterminism all 1.14.1-2 [8620 B]
Get: 77 http://deb.debian.org/debian trixie/main i386 libelf1t64 i386 0.192-4 [195 kB]
Get: 78 http://deb.debian.org/debian trixie/main i386 dwz i386 0.15-1+b1 [116 kB]
Get: 79 http://deb.debian.org/debian trixie/main i386 gettext i386 0.23.1-1 [1714 kB]
Get: 80 http://deb.debian.org/debian trixie/main i386 intltool-debian all 0.35.0+20060710.6 [22.9 kB]
Get: 81 http://deb.debian.org/debian trixie/main i386 po-debconf all 1.0.21+nmu1 [248 kB]
Get: 82 http://deb.debian.org/debian trixie/main i386 debhelper all 13.24.1 [920 kB]
Get: 83 http://deb.debian.org/debian trixie/main i386 dh-python all 6.20250308 [115 kB]
Get: 84 http://deb.debian.org/debian trixie/main i386 xml-core all 0.19 [20.1 kB]
Get: 85 http://deb.debian.org/debian trixie/main i386 docutils-common all 0.21.2+dfsg-2 [128 kB]
Get: 86 http://deb.debian.org/debian trixie/main i386 fonts-mathjax all 2.7.9+dfsg-1 [2210 kB]
Get: 87 http://deb.debian.org/debian trixie/main i386 hdf5-helpers i386 1.14.5+repack-3 [26.6 kB]
Get: 88 http://deb.debian.org/debian trixie/main i386 libgssrpc4t64 i386 1.21.3-5 [63.6 kB]
Get: 89 http://deb.debian.org/debian trixie/main i386 libkadm5clnt-mit12 i386 1.21.3-5 [44.2 kB]
Get: 90 http://deb.debian.org/debian trixie/main i386 libkdb5-10t64 i386 1.21.3-5 [45.6 kB]
Get: 91 http://deb.debian.org/debian trixie/main i386 libkadm5srv-mit12 i386 1.21.3-5 [57.9 kB]
Get: 92 http://deb.debian.org/debian trixie/main i386 krb5-multidev i386 1.21.3-5 [126 kB]
Get: 93 http://deb.debian.org/debian trixie/main i386 libaec0 i386 1.1.3-1+b1 [25.0 kB]
Get: 94 http://deb.debian.org/debian trixie/main i386 libsz2 i386 1.1.3-1+b1 [8128 B]
Get: 95 http://deb.debian.org/debian trixie/main i386 libaec-dev i386 1.1.3-1+b1 [23.0 kB]
Get: 96 http://deb.debian.org/debian trixie/main i386 libblas-dev i386 3.12.1-2 [162 kB]
Get: 97 http://deb.debian.org/debian trixie/main i386 libbrotli-dev i386 1.1.0-2+b7 [313 kB]
Get: 98 http://deb.debian.org/debian trixie/main i386 libidn2-dev i386 2.3.8-2 [104 kB]
Get: 99 http://deb.debian.org/debian trixie/main i386 libkrb5-dev i386 1.21.3-5 [16.1 kB]
Get: 100 http://deb.debian.org/debian trixie/main i386 libldap-dev i386 2.6.9+dfsg-2 [332 kB]
Get: 101 http://deb.debian.org/debian trixie/main i386 libpkgconf3 i386 1.8.1-4 [38.4 kB]
Get: 102 http://deb.debian.org/debian trixie/main i386 pkgconf-bin i386 1.8.1-4 [30.6 kB]
Get: 103 http://deb.debian.org/debian trixie/main i386 pkgconf i386 1.8.1-4 [26.2 kB]
Get: 104 http://deb.debian.org/debian trixie/main i386 libnghttp2-dev i386 1.64.0-1 [123 kB]
Get: 105 http://deb.debian.org/debian trixie/main i386 libnghttp3-dev i386 1.8.0-1 [104 kB]
Get: 106 http://deb.debian.org/debian trixie/main i386 libpsl-dev i386 0.21.2-1.1+b1 [78.4 kB]
Get: 107 http://deb.debian.org/debian trixie/main i386 libgmpxx4ldbl i386 2:6.3.0+dfsg-3 [329 kB]
Get: 108 http://deb.debian.org/debian trixie/main i386 libgmp-dev i386 2:6.3.0+dfsg-3 [661 kB]
Get: 109 http://deb.debian.org/debian trixie/main i386 libevent-2.1-7t64 i386 2.1.12-stable-10+b1 [195 kB]
Get: 110 http://deb.debian.org/debian trixie/main i386 libunbound8 i386 1.22.0-1+b1 [633 kB]
Get: 111 http://deb.debian.org/debian trixie/main i386 libgnutls-dane0t64 i386 3.8.9-2 [453 kB]
Get: 112 http://deb.debian.org/debian trixie/main i386 libgnutls-openssl27t64 i386 3.8.9-2 [453 kB]
Get: 113 http://deb.debian.org/debian trixie/main i386 libp11-kit-dev i386 0.25.5-3 [208 kB]
Get: 114 http://deb.debian.org/debian trixie/main i386 libtasn1-6-dev i386 4.20.0-2 [103 kB]
Get: 115 http://deb.debian.org/debian trixie/main i386 nettle-dev i386 3.10.1-1 [1335 kB]
Get: 116 http://deb.debian.org/debian trixie/main i386 libgnutls28-dev i386 3.8.9-2 [1464 kB]
Get: 117 http://deb.debian.org/debian trixie/main i386 zlib1g-dev i386 1:1.3.dfsg+really1.3.1-1+b1 [916 kB]
Get: 118 http://deb.debian.org/debian trixie/main i386 librtmp-dev i386 2.4+20151223.gitfa8646d.1-2+b5 [72.3 kB]
Get: 119 http://deb.debian.org/debian trixie/main i386 libssl-dev i386 3.4.1-1 [2837 kB]
Get: 120 http://deb.debian.org/debian trixie/main i386 libssh2-1-dev i386 1.11.1-1 [407 kB]
Get: 121 http://deb.debian.org/debian trixie/main i386 libzstd-dev i386 1.5.7+dfsg-1 [377 kB]
Get: 122 http://deb.debian.org/debian trixie/main i386 libcurl4-openssl-dev i386 8.13.0~rc2-1 [560 kB]
Get: 123 http://deb.debian.org/debian trixie/main i386 libexpat1-dev i386 2.6.4-1 [165 kB]
Get: 124 http://deb.debian.org/debian trixie/main i386 libhdf5-310 i386 1.14.5+repack-3 [1327 kB]
Get: 125 http://deb.debian.org/debian trixie/main i386 libhdf5-cpp-310 i386 1.14.5+repack-3 [140 kB]
Get: 126 http://deb.debian.org/debian trixie/main i386 libhdf5-fortran-310 i386 1.14.5+repack-3 [119 kB]
Get: 127 http://deb.debian.org/debian trixie/main i386 libhdf5-hl-310 i386 1.14.5+repack-3 [81.6 kB]
Get: 128 http://deb.debian.org/debian trixie/main i386 libhdf5-hl-fortran-310 i386 1.14.5+repack-3 [45.7 kB]
Get: 129 http://deb.debian.org/debian trixie/main i386 libhdf5-hl-cpp-310 i386 1.14.5+repack-3 [24.9 kB]
Get: 130 http://deb.debian.org/debian trixie/main i386 libjpeg62-turbo i386 1:2.1.5-3.1 [170 kB]
Get: 131 http://deb.debian.org/debian trixie/main i386 libjpeg62-turbo-dev i386 1:2.1.5-3.1 [304 kB]
Get: 132 http://deb.debian.org/debian trixie/main i386 libjpeg-dev i386 1:2.1.5-3.1 [72.0 kB]
Get: 133 http://deb.debian.org/debian trixie/main i386 libhdf5-dev i386 1.14.5+repack-3 [3319 kB]
Get: 134 http://deb.debian.org/debian trixie/main i386 libjs-jquery all 3.6.1+dfsg+~3.5.14-1 [326 kB]
Get: 135 http://deb.debian.org/debian trixie/main i386 libjs-mathjax all 2.7.9+dfsg-1 [5667 kB]
Get: 136 http://deb.debian.org/debian trixie/main i386 libjs-underscore all 1.13.4~dfsg+~1.11.4-3 [116 kB]
Get: 137 http://deb.debian.org/debian trixie/main i386 libjs-sphinxdoc all 8.1.3-5 [30.5 kB]
Get: 138 http://deb.debian.org/debian trixie/main i386 libjson-perl all 4.10000-1 [87.5 kB]
Get: 139 http://deb.debian.org/debian trixie/main i386 liblapack-dev i386 3.12.1-2 [4458 kB]
Get: 140 http://deb.debian.org/debian trixie/main i386 libpython3.13 i386 3.13.2-2 [2202 kB]
Get: 141 http://deb.debian.org/debian trixie/main i386 libpython3.13-dev i386 3.13.2-2 [5188 kB]
Get: 142 http://deb.debian.org/debian trixie/main i386 libpython3-dev i386 3.13.2-2 [10.3 kB]
Get: 143 http://deb.debian.org/debian trixie/main i386 python-babel-localedata all 2.17.0-1 [6050 kB]
Get: 144 http://deb.debian.org/debian trixie/main i386 python3-alabaster all 0.7.16-0.1 [27.9 kB]
Get: 145 http://deb.debian.org/debian trixie/main i386 python3-all i386 3.13.2-2 [1044 B]
Get: 146 http://deb.debian.org/debian trixie/main i386 python3-autocommand all 2.2.2-3 [13.6 kB]
Get: 147 http://deb.debian.org/debian trixie/main i386 python3-babel all 2.17.0-1 [117 kB]
Get: 148 http://deb.debian.org/debian trixie/main i386 python3-certifi all 2025.1.31+ds-1 [9652 B]
Get: 149 http://deb.debian.org/debian trixie/main i386 python3-chardet all 5.2.0+dfsg-2 [108 kB]
Get: 150 http://deb.debian.org/debian trixie/main i386 python3-charset-normalizer i386 3.4.1-1+b1 [127 kB]
Get: 151 http://deb.debian.org/debian trixie/main i386 python3-defusedxml all 0.7.1-3 [43.4 kB]
Get: 152 http://deb.debian.org/debian trixie/main i386 python3-roman all 5.0-1 [10.6 kB]
Get: 153 http://deb.debian.org/debian trixie/main i386 python3-docutils all 0.21.2+dfsg-2 [403 kB]
Get: 154 http://deb.debian.org/debian trixie/main i386 python3-idna all 3.10-1 [42.0 kB]
Get: 155 http://deb.debian.org/debian trixie/main i386 python3-imagesize all 1.4.1-1 [6688 B]
Get: 156 http://deb.debian.org/debian trixie/main i386 python3-more-itertools all 10.6.0-1 [65.3 kB]
Get: 157 http://deb.debian.org/debian trixie/main i386 python3-typing-extensions all 4.12.2-2 [73.0 kB]
Get: 158 http://deb.debian.org/debian trixie/main i386 python3-typeguard all 4.4.2-1 [37.3 kB]
Get: 159 http://deb.debian.org/debian trixie/main i386 python3-inflect all 7.3.1-2 [32.4 kB]
Get: 160 http://deb.debian.org/debian trixie/main i386 python3-jaraco.functools all 4.1.0-1 [12.0 kB]
Get: 161 http://deb.debian.org/debian trixie/main i386 python3-pkg-resources all 75.8.0-1 [222 kB]
Get: 162 http://deb.debian.org/debian trixie/main i386 python3-jaraco.text all 4.0.0-1 [11.4 kB]
Get: 163 http://deb.debian.org/debian trixie/main i386 python3-zipp all 3.21.0-1 [10.6 kB]
Get: 164 http://deb.debian.org/debian trixie/main i386 python3-setuptools all 75.8.0-1 [724 kB]
Get: 165 http://deb.debian.org/debian trixie/main i386 python3-jaraco.context all 6.0.1-1 [8276 B]
Get: 166 http://deb.debian.org/debian trixie/main i386 python3-markupsafe i386 2.1.5-1+b3 [14.0 kB]
Get: 167 http://deb.debian.org/debian trixie/main i386 python3-jinja2 all 3.1.5-2 [107 kB]
Get: 168 http://deb.debian.org/debian trixie/main i386 python3-packaging all 24.2-1 [55.3 kB]
Get: 169 http://deb.debian.org/debian trixie/main i386 python3-pygments all 2.18.0+dfsg-2 [836 kB]
Get: 170 http://deb.debian.org/debian trixie/main i386 python3-urllib3 all 2.3.0-2 [114 kB]
Get: 171 http://deb.debian.org/debian trixie/main i386 python3-requests all 2.32.3+dfsg-4 [72.1 kB]
Get: 172 http://deb.debian.org/debian trixie/main i386 python3-snowballstemmer all 2.2.0-4 [58.0 kB]
Get: 173 http://deb.debian.org/debian trixie/main i386 sphinx-common all 8.1.3-5 [617 kB]
Get: 174 http://deb.debian.org/debian trixie/main i386 python3-sphinx all 8.1.3-5 [468 kB]
Fetched 111 MB in 2s (55.2 MB/s)
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Adding 'diversion of /lib/i386-linux-gnu/libhistory.so.8 to /lib/i386-linux-gnu/libhistory.so.8.usr-is-merged by libreadline8t64'
Adding 'diversion of /lib/i386-linux-gnu/libhistory.so.8.2 to /lib/i386-linux-gnu/libhistory.so.8.2.usr-is-merged by libreadline8t64'
Adding 'diversion of /lib/i386-linux-gnu/libreadline.so.8 to /lib/i386-linux-gnu/libreadline.so.8.usr-is-merged by libreadline8t64'
Adding 'diversion of /lib/i386-linux-gnu/libreadline.so.8.2 to /lib/i386-linux-gnu/libreadline.so.8.2.usr-is-merged by libreadline8t64'
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Current default time zone: 'Etc/UTC'
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Reading package lists...
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-> Finished parsing the build-deps
I: Building the package
I: Running cd /build/reproducible-path/chemps2-1.8.12/ && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games" HOME="/nonexistent/first-build" dpkg-buildpackage -us -uc -b && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games" HOME="/nonexistent/first-build" dpkg-genchanges -S > ../chemps2_1.8.12-4_source.changes
dpkg-buildpackage: info: source package chemps2
dpkg-buildpackage: info: source version 1.8.12-4
dpkg-buildpackage: info: source distribution unstable
dpkg-buildpackage: info: source changed by Michael Banck <mbanck@debian.org>
dpkg-source --before-build .
dpkg-buildpackage: info: host architecture i386
debian/rules clean
dh clean
debian/rules override_dh_clean
make[1]: Entering directory '/build/reproducible-path/chemps2-1.8.12'
dh_clean
rm -rf build-sphinx PyCheMPS2/build PyCheMPS2/PyCheMPS2.cpp PyCheMPS2/*.pyc PyCheMPS2/CheMPS2.egg-info
make[1]: Leaving directory '/build/reproducible-path/chemps2-1.8.12'
debian/rules binary
dh binary
dh_update_autotools_config
dh_autoreconf
debian/rules override_dh_auto_configure
make[1]: Entering directory '/build/reproducible-path/chemps2-1.8.12'
dh_auto_configure -- -DCMAKE_INSTALL_LIBDIR=lib/i386-linux-gnu \
-DENABLE_XHOST=OFF \
-DBUILD_SPHINX=ON \
-DHDF5_INCLUDE_DIRS=/usr/include/hdf5/serial \
-DCMAKE_BUILD_TYPE=release
cd obj-i686-linux-gnu && DEB_PYTHON_INSTALL_LAYOUT=deb PKG_CONFIG=/usr/bin/pkg-config 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_USE_PACKAGE_REGISTRY=OFF -DCMAKE_FIND_PACKAGE_NO_PACKAGE_REGISTRY=ON -DFETCHCONTENT_FULLY_DISCONNECTED=ON -DCMAKE_INSTALL_RUNSTATEDIR=/run -DCMAKE_SKIP_INSTALL_ALL_DEPENDENCY=ON "-GUnix Makefiles" -DCMAKE_VERBOSE_MAKEFILE=ON -DCMAKE_INSTALL_LIBDIR=lib/i386-linux-gnu -DCMAKE_INSTALL_LIBDIR=lib/i386-linux-gnu -DENABLE_XHOST=OFF -DBUILD_SPHINX=ON -DHDF5_INCLUDE_DIRS=/usr/include/hdf5/serial -DCMAKE_BUILD_TYPE=release ..
CMake Warning (dev) at CMakeLists.txt:1 (project):
cmake_minimum_required() should be called prior to this top-level project()
call. Please see the cmake-commands(7) manual for usage documentation of
both commands.
This warning is for project developers. Use -Wno-dev to suppress it.
-- The C compiler identification is GNU 14.2.0
-- The CXX compiler identification is GNU 14.2.0
-- 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
CMake Deprecation Warning at CMakeLists.txt:12 (cmake_minimum_required):
Compatibility with CMake < 3.10 will be removed from a future version of
CMake.
Update the VERSION argument <min> value. Or, use the <min>...<max> syntax
to tell CMake that the project requires at least <min> but has been updated
to work with policies introduced by <max> or earlier.
-- 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
-- Performing Test CMAKE_HAVE_LIBC_PTHREAD
-- Performing Test CMAKE_HAVE_LIBC_PTHREAD - Success
-- Found Threads: TRUE
-- LAPACK detected.
-- Found TargetLAPACK: Found LAPACK: /usr/lib/i386-linux-gnu/liblapack.so;/usr/lib/i386-linux-gnu/libblas.so
-- HDF5 detected.
-- Found TargetHDF5: Found HDF5: /usr/lib/i386-linux-gnu/hdf5/serial/libhdf5.so;/usr/lib/i386-linux-gnu/libcrypto.so;/usr/lib/i386-linux-gnu/libcurl.so;/usr/lib/i386-linux-gnu/libpthread.a;/usr/lib/i386-linux-gnu/libsz.so;/usr/lib/i386-linux-gnu/libz.so;/usr/lib/i386-linux-gnu/libdl.a;/usr/lib/i386-linux-gnu/libm.so (found version 1.14.5) (found version "1.14.5")
-- Found Sphinx: /usr/bin/sphinx-build
-- Configuring done (2.7s)
-- Generating done (0.1s)
CMake Warning:
Manually-specified variables were not used by the project:
CMAKE_EXPORT_NO_PACKAGE_REGISTRY
CMAKE_FIND_PACKAGE_NO_PACKAGE_REGISTRY
FETCHCONTENT_FULLY_DISCONNECTED
-- Build files have been written to: /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu
make[1]: Leaving directory '/build/reproducible-path/chemps2-1.8.12'
debian/rules override_dh_auto_build
make[1]: Entering directory '/build/reproducible-path/chemps2-1.8.12'
dh_auto_build -- VERBOSE=1
cd obj-i686-linux-gnu && make -j22 "INSTALL=install --strip-program=true" VERBOSE=1 VERBOSE=1
make[2]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
/usr/bin/cmake -S/build/reproducible-path/chemps2-1.8.12 -B/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu --check-build-system CMakeFiles/Makefile.cmake 0
/usr/bin/cmake -E cmake_progress_start /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CMakeFiles /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu//CMakeFiles/progress.marks
make -f CMakeFiles/Makefile2 all
make[3]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
make -f CheMPS2/CMakeFiles/chemps2-base.dir/build.make CheMPS2/CMakeFiles/chemps2-base.dir/depend
make[4]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/chemps2-1.8.12 /build/reproducible-path/chemps2-1.8.12/CheMPS2 /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2/CMakeFiles/chemps2-base.dir/DependInfo.cmake "--color="
make[4]: Leaving directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
make -f CheMPS2/CMakeFiles/chemps2-base.dir/build.make CheMPS2/CMakeFiles/chemps2-base.dir/build
make[4]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
[ 5%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/CASPT2.cpp.o
[ 5%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/CASSCFnewtonraphson.cpp.o
[ 5%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/CASSCFpt2.cpp.o
[ 5%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/CASSCFdebug.cpp.o
[ 6%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/ConvergenceScheme.cpp.o
[ 6%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/CASSCF.cpp.o
[ 7%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/ConjugateGradient.cpp.o
[ 9%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Cumulant.cpp.o
[ 9%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Correlations.cpp.o
[ 10%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DIIS.cpp.o
[ 11%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Davidson.cpp.o
[ 14%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRGmpsio.cpp.o
[ 14%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRG.cpp.o
[ 15%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRGfock.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/CASPT2.cpp.o -MF CMakeFiles/chemps2-base.dir/CASPT2.cpp.o.d -o CMakeFiles/chemps2-base.dir/CASPT2.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/CASPT2.cpp
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/CASSCF.cpp.o -MF CMakeFiles/chemps2-base.dir/CASSCF.cpp.o.d -o CMakeFiles/chemps2-base.dir/CASSCF.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/CASSCF.cpp
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/CASSCFdebug.cpp.o -MF CMakeFiles/chemps2-base.dir/CASSCFdebug.cpp.o.d -o CMakeFiles/chemps2-base.dir/CASSCFdebug.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/CASSCFdebug.cpp
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/CASSCFnewtonraphson.cpp.o -MF CMakeFiles/chemps2-base.dir/CASSCFnewtonraphson.cpp.o.d -o CMakeFiles/chemps2-base.dir/CASSCFnewtonraphson.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/CASSCFnewtonraphson.cpp
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/CASSCFpt2.cpp.o -MF CMakeFiles/chemps2-base.dir/CASSCFpt2.cpp.o.d -o CMakeFiles/chemps2-base.dir/CASSCFpt2.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/CASSCFpt2.cpp
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/ConjugateGradient.cpp.o -MF CMakeFiles/chemps2-base.dir/ConjugateGradient.cpp.o.d -o CMakeFiles/chemps2-base.dir/ConjugateGradient.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/ConjugateGradient.cpp
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/ConvergenceScheme.cpp.o -MF CMakeFiles/chemps2-base.dir/ConvergenceScheme.cpp.o.d -o CMakeFiles/chemps2-base.dir/ConvergenceScheme.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/ConvergenceScheme.cpp
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/Correlations.cpp.o -MF CMakeFiles/chemps2-base.dir/Correlations.cpp.o.d -o CMakeFiles/chemps2-base.dir/Correlations.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/Correlations.cpp
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/Cumulant.cpp.o -MF CMakeFiles/chemps2-base.dir/Cumulant.cpp.o.d -o CMakeFiles/chemps2-base.dir/Cumulant.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/Cumulant.cpp
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/Davidson.cpp.o -MF CMakeFiles/chemps2-base.dir/Davidson.cpp.o.d -o CMakeFiles/chemps2-base.dir/Davidson.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/Davidson.cpp
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/DIIS.cpp.o -MF CMakeFiles/chemps2-base.dir/DIIS.cpp.o.d -o CMakeFiles/chemps2-base.dir/DIIS.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/DIIS.cpp
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/DMRG.cpp.o -MF CMakeFiles/chemps2-base.dir/DMRG.cpp.o.d -o CMakeFiles/chemps2-base.dir/DMRG.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/DMRG.cpp
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/DMRGfock.cpp.o -MF CMakeFiles/chemps2-base.dir/DMRGfock.cpp.o.d -o CMakeFiles/chemps2-base.dir/DMRGfock.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/DMRGfock.cpp
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/DMRGmpsio.cpp.o -MF CMakeFiles/chemps2-base.dir/DMRGmpsio.cpp.o.d -o CMakeFiles/chemps2-base.dir/DMRGmpsio.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/DMRGmpsio.cpp
[ 16%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRGoperators.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/DMRGoperators.cpp.o -MF CMakeFiles/chemps2-base.dir/DMRGoperators.cpp.o.d -o CMakeFiles/chemps2-base.dir/DMRGoperators.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/DMRGoperators.cpp
[ 17%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRGoperators3RDM.cpp.o
[ 18%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRGSCFindices.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/DMRGoperators3RDM.cpp.o -MF CMakeFiles/chemps2-base.dir/DMRGoperators3RDM.cpp.o.d -o CMakeFiles/chemps2-base.dir/DMRGoperators3RDM.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/DMRGoperators3RDM.cpp
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/DMRGSCFindices.cpp.o -MF CMakeFiles/chemps2-base.dir/DMRGSCFindices.cpp.o.d -o CMakeFiles/chemps2-base.dir/DMRGSCFindices.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/DMRGSCFindices.cpp
[ 19%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRGSCFintegrals.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/DMRGSCFintegrals.cpp.o -MF CMakeFiles/chemps2-base.dir/DMRGSCFintegrals.cpp.o.d -o CMakeFiles/chemps2-base.dir/DMRGSCFintegrals.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/DMRGSCFintegrals.cpp
[ 21%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRGSCFoptions.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/DMRGSCFoptions.cpp.o -MF CMakeFiles/chemps2-base.dir/DMRGSCFoptions.cpp.o.d -o CMakeFiles/chemps2-base.dir/DMRGSCFoptions.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/DMRGSCFoptions.cpp
[ 21%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRGSCFmatrix.cpp.o
[ 22%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRGSCFrotations.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/DMRGSCFmatrix.cpp.o -MF CMakeFiles/chemps2-base.dir/DMRGSCFmatrix.cpp.o.d -o CMakeFiles/chemps2-base.dir/DMRGSCFmatrix.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/DMRGSCFmatrix.cpp
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/DMRGSCFrotations.cpp.o -MF CMakeFiles/chemps2-base.dir/DMRGSCFrotations.cpp.o.d -o CMakeFiles/chemps2-base.dir/DMRGSCFrotations.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/DMRGSCFrotations.cpp
[ 23%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRGSCFunitary.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/DMRGSCFunitary.cpp.o -MF CMakeFiles/chemps2-base.dir/DMRGSCFunitary.cpp.o.d -o CMakeFiles/chemps2-base.dir/DMRGSCFunitary.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/DMRGSCFunitary.cpp
[ 25%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRGSCFwtilde.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/DMRGSCFwtilde.cpp.o -MF CMakeFiles/chemps2-base.dir/DMRGSCFwtilde.cpp.o.d -o CMakeFiles/chemps2-base.dir/DMRGSCFwtilde.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/DMRGSCFwtilde.cpp
[ 26%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/DMRGtechnics.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/DMRGtechnics.cpp.o -MF CMakeFiles/chemps2-base.dir/DMRGtechnics.cpp.o.d -o CMakeFiles/chemps2-base.dir/DMRGtechnics.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/DMRGtechnics.cpp
[ 27%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/EdmistonRuedenberg.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/EdmistonRuedenberg.cpp.o -MF CMakeFiles/chemps2-base.dir/EdmistonRuedenberg.cpp.o.d -o CMakeFiles/chemps2-base.dir/EdmistonRuedenberg.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/EdmistonRuedenberg.cpp
[ 28%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Excitation.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/Excitation.cpp.o -MF CMakeFiles/chemps2-base.dir/Excitation.cpp.o.d -o CMakeFiles/chemps2-base.dir/Excitation.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/Excitation.cpp
[ 29%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/FCI.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/FCI.cpp.o -MF CMakeFiles/chemps2-base.dir/FCI.cpp.o.d -o CMakeFiles/chemps2-base.dir/FCI.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/FCI.cpp
[ 30%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/FourIndex.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/FourIndex.cpp.o -MF CMakeFiles/chemps2-base.dir/FourIndex.cpp.o.d -o CMakeFiles/chemps2-base.dir/FourIndex.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/FourIndex.cpp
[ 31%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Hamiltonian.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/Hamiltonian.cpp.o -MF CMakeFiles/chemps2-base.dir/Hamiltonian.cpp.o.d -o CMakeFiles/chemps2-base.dir/Hamiltonian.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/Hamiltonian.cpp
[ 32%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Heff.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/Heff.cpp.o -MF CMakeFiles/chemps2-base.dir/Heff.cpp.o.d -o CMakeFiles/chemps2-base.dir/Heff.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/Heff.cpp
[ 33%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/HeffDiagonal.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/HeffDiagonal.cpp.o -MF CMakeFiles/chemps2-base.dir/HeffDiagonal.cpp.o.d -o CMakeFiles/chemps2-base.dir/HeffDiagonal.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/HeffDiagonal.cpp
[ 34%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/HeffDiagrams1.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/HeffDiagrams1.cpp.o -MF CMakeFiles/chemps2-base.dir/HeffDiagrams1.cpp.o.d -o CMakeFiles/chemps2-base.dir/HeffDiagrams1.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/HeffDiagrams1.cpp
[ 35%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/HeffDiagrams3.cpp.o
[ 36%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/HeffDiagrams2.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/HeffDiagrams3.cpp.o -MF CMakeFiles/chemps2-base.dir/HeffDiagrams3.cpp.o.d -o CMakeFiles/chemps2-base.dir/HeffDiagrams3.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/HeffDiagrams3.cpp
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/HeffDiagrams2.cpp.o -MF CMakeFiles/chemps2-base.dir/HeffDiagrams2.cpp.o.d -o CMakeFiles/chemps2-base.dir/HeffDiagrams2.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/HeffDiagrams2.cpp
[ 38%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/HeffDiagrams4.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/HeffDiagrams4.cpp.o -MF CMakeFiles/chemps2-base.dir/HeffDiagrams4.cpp.o.d -o CMakeFiles/chemps2-base.dir/HeffDiagrams4.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/HeffDiagrams4.cpp
[ 39%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/HeffDiagrams5.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/HeffDiagrams5.cpp.o -MF CMakeFiles/chemps2-base.dir/HeffDiagrams5.cpp.o.d -o CMakeFiles/chemps2-base.dir/HeffDiagrams5.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/HeffDiagrams5.cpp
[ 40%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Initialize.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/Initialize.cpp.o -MF CMakeFiles/chemps2-base.dir/Initialize.cpp.o.d -o CMakeFiles/chemps2-base.dir/Initialize.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/Initialize.cpp
[ 41%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Irreps.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/Irreps.cpp.o -MF CMakeFiles/chemps2-base.dir/Irreps.cpp.o.d -o CMakeFiles/chemps2-base.dir/Irreps.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/Irreps.cpp
[ 42%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/PrintLicense.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/PrintLicense.cpp.o -MF CMakeFiles/chemps2-base.dir/PrintLicense.cpp.o.d -o CMakeFiles/chemps2-base.dir/PrintLicense.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/PrintLicense.cpp
[ 43%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Molden.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/Molden.cpp.o -MF CMakeFiles/chemps2-base.dir/Molden.cpp.o.d -o CMakeFiles/chemps2-base.dir/Molden.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/Molden.cpp
[ 44%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Problem.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/Problem.cpp.o -MF CMakeFiles/chemps2-base.dir/Problem.cpp.o.d -o CMakeFiles/chemps2-base.dir/Problem.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/Problem.cpp
[ 45%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Sobject.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/Sobject.cpp.o -MF CMakeFiles/chemps2-base.dir/Sobject.cpp.o.d -o CMakeFiles/chemps2-base.dir/Sobject.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/Sobject.cpp
[ 46%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/SyBookkeeper.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/SyBookkeeper.cpp.o -MF CMakeFiles/chemps2-base.dir/SyBookkeeper.cpp.o.d -o CMakeFiles/chemps2-base.dir/SyBookkeeper.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/SyBookkeeper.cpp
[ 47%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Tensor3RDM.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/Tensor3RDM.cpp.o -MF CMakeFiles/chemps2-base.dir/Tensor3RDM.cpp.o.d -o CMakeFiles/chemps2-base.dir/Tensor3RDM.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/Tensor3RDM.cpp
[ 48%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TensorF0.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/TensorF0.cpp.o -MF CMakeFiles/chemps2-base.dir/TensorF0.cpp.o.d -o CMakeFiles/chemps2-base.dir/TensorF0.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/TensorF0.cpp
[ 50%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TensorF1.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/TensorF1.cpp.o -MF CMakeFiles/chemps2-base.dir/TensorF1.cpp.o.d -o CMakeFiles/chemps2-base.dir/TensorF1.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/TensorF1.cpp
[ 51%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TensorGYZ.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/TensorGYZ.cpp.o -MF CMakeFiles/chemps2-base.dir/TensorGYZ.cpp.o.d -o CMakeFiles/chemps2-base.dir/TensorGYZ.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/TensorGYZ.cpp
[ 52%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TensorKM.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/TensorKM.cpp.o -MF CMakeFiles/chemps2-base.dir/TensorKM.cpp.o.d -o CMakeFiles/chemps2-base.dir/TensorKM.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/TensorKM.cpp
[ 53%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TensorL.cpp.o
[ 54%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TensorO.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/TensorO.cpp.o -MF CMakeFiles/chemps2-base.dir/TensorO.cpp.o.d -o CMakeFiles/chemps2-base.dir/TensorO.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/TensorO.cpp
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/TensorL.cpp.o -MF CMakeFiles/chemps2-base.dir/TensorL.cpp.o.d -o CMakeFiles/chemps2-base.dir/TensorL.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/TensorL.cpp
[ 55%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TensorOperator.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/TensorOperator.cpp.o -MF CMakeFiles/chemps2-base.dir/TensorOperator.cpp.o.d -o CMakeFiles/chemps2-base.dir/TensorOperator.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/TensorOperator.cpp
[ 56%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TensorQ.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/TensorQ.cpp.o -MF CMakeFiles/chemps2-base.dir/TensorQ.cpp.o.d -o CMakeFiles/chemps2-base.dir/TensorQ.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/TensorQ.cpp
[ 57%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TensorS0.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/TensorS0.cpp.o -MF CMakeFiles/chemps2-base.dir/TensorS0.cpp.o.d -o CMakeFiles/chemps2-base.dir/TensorS0.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/TensorS0.cpp
[ 58%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TensorS1.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/TensorS1.cpp.o -MF CMakeFiles/chemps2-base.dir/TensorS1.cpp.o.d -o CMakeFiles/chemps2-base.dir/TensorS1.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/TensorS1.cpp
[ 59%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TensorT.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/TensorT.cpp.o -MF CMakeFiles/chemps2-base.dir/TensorT.cpp.o.d -o CMakeFiles/chemps2-base.dir/TensorT.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/TensorT.cpp
[ 60%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TensorX.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/TensorX.cpp.o -MF CMakeFiles/chemps2-base.dir/TensorX.cpp.o.d -o CMakeFiles/chemps2-base.dir/TensorX.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/TensorX.cpp
[ 61%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/ThreeDM.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/ThreeDM.cpp.o -MF CMakeFiles/chemps2-base.dir/ThreeDM.cpp.o.d -o CMakeFiles/chemps2-base.dir/ThreeDM.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/ThreeDM.cpp
[ 63%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TwoDM.cpp.o
[ 64%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/TwoIndex.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/TwoDM.cpp.o -MF CMakeFiles/chemps2-base.dir/TwoDM.cpp.o.d -o CMakeFiles/chemps2-base.dir/TwoDM.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/TwoDM.cpp
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/TwoIndex.cpp.o -MF CMakeFiles/chemps2-base.dir/TwoIndex.cpp.o.d -o CMakeFiles/chemps2-base.dir/TwoIndex.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/TwoIndex.cpp
[ 65%] Building CXX object CheMPS2/CMakeFiles/chemps2-base.dir/Wigner.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -I/usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -fPIC -MD -MT CheMPS2/CMakeFiles/chemps2-base.dir/Wigner.cpp.o -MF CMakeFiles/chemps2-base.dir/Wigner.cpp.o.d -o CMakeFiles/chemps2-base.dir/Wigner.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/Wigner.cpp
make[4]: Leaving directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-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/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/chemps2-1.8.12 /build/reproducible-path/chemps2-1.8.12/CheMPS2 /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2/CMakeFiles/chemps2-shared.dir/DependInfo.cmake "--color="
make[4]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/chemps2-1.8.12 /build/reproducible-path/chemps2-1.8.12/CheMPS2 /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2/CMakeFiles/chemps2-static.dir/DependInfo.cmake "--color="
make[4]: Leaving directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
make[4]: Leaving directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
make -f CheMPS2/CMakeFiles/chemps2-shared.dir/build.make CheMPS2/CMakeFiles/chemps2-shared.dir/build
make -f CheMPS2/CMakeFiles/chemps2-static.dir/build.make CheMPS2/CMakeFiles/chemps2-static.dir/build
make[4]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
make[4]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
[ 67%] Linking CXX static library libchemps2.a
[ 67%] Linking CXX shared library libchemps2.so
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/cmake -E cmake_link_script CMakeFiles/chemps2-shared.dir/link.txt --verbose=1
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/cmake -P CMakeFiles/chemps2-static.dir/cmake_clean_target.cmake
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-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/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
[ 67%] Built target chemps2-static
/usr/bin/c++ -fPIC -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -Wl,--dependency-file=CMakeFiles/chemps2-shared.dir/link.d -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" -L/usr/lib/libeatmydata -Wl,-rpath,/usr/lib/libeatmydata:/usr/lib/i386-linux-gnu/hdf5/serial: -llapack -lblas /usr/lib/i386-linux-gnu/hdf5/serial/libhdf5.so -lcrypto -lcurl -Wl,-Bstatic -lpthread -Wl,-Bdynamic -lsz -lz -Wl,-Bstatic -ldl -Wl,-Bdynamic -lm
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/cmake -E cmake_symlink_library libchemps2.so.3 libchemps2.so.3 libchemps2.so
make[4]: Leaving directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-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/test1.dir/build.make tests/CMakeFiles/test1.dir/depend
make -f tests/CMakeFiles/test2.dir/build.make tests/CMakeFiles/test2.dir/depend
make -f tests/CMakeFiles/test3.dir/build.make tests/CMakeFiles/test3.dir/depend
make -f tests/CMakeFiles/test4.dir/build.make tests/CMakeFiles/test4.dir/depend
make[4]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/chemps2-1.8.12 /build/reproducible-path/chemps2-1.8.12/CheMPS2 /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2/CMakeFiles/chemps2-bin.dir/DependInfo.cmake "--color="
make -f tests/CMakeFiles/test5.dir/build.make tests/CMakeFiles/test5.dir/depend
make[4]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/chemps2-1.8.12 /build/reproducible-path/chemps2-1.8.12/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests/CMakeFiles/test1.dir/DependInfo.cmake "--color="
make[4]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/chemps2-1.8.12 /build/reproducible-path/chemps2-1.8.12/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests/CMakeFiles/test2.dir/DependInfo.cmake "--color="
make -f tests/CMakeFiles/test6.dir/build.make tests/CMakeFiles/test6.dir/depend
make -f tests/CMakeFiles/test7.dir/build.make tests/CMakeFiles/test7.dir/depend
make[4]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/chemps2-1.8.12 /build/reproducible-path/chemps2-1.8.12/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests/CMakeFiles/test3.dir/DependInfo.cmake "--color="
make -f tests/CMakeFiles/test8.dir/build.make tests/CMakeFiles/test8.dir/depend
make[4]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/chemps2-1.8.12 /build/reproducible-path/chemps2-1.8.12/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests/CMakeFiles/test4.dir/DependInfo.cmake "--color="
make -f tests/CMakeFiles/test9.dir/build.make tests/CMakeFiles/test9.dir/depend
make[4]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/chemps2-1.8.12 /build/reproducible-path/chemps2-1.8.12/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests/CMakeFiles/test5.dir/DependInfo.cmake "--color="
make[4]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/chemps2-1.8.12 /build/reproducible-path/chemps2-1.8.12/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests/CMakeFiles/test6.dir/DependInfo.cmake "--color="
make -f tests/CMakeFiles/test10.dir/build.make tests/CMakeFiles/test10.dir/depend
make[4]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/chemps2-1.8.12 /build/reproducible-path/chemps2-1.8.12/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests/CMakeFiles/test7.dir/DependInfo.cmake "--color="
make -f tests/CMakeFiles/test11.dir/build.make tests/CMakeFiles/test11.dir/depend
make[4]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/chemps2-1.8.12 /build/reproducible-path/chemps2-1.8.12/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests/CMakeFiles/test8.dir/DependInfo.cmake "--color="
make -f tests/CMakeFiles/test12.dir/build.make tests/CMakeFiles/test12.dir/depend
make[4]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/chemps2-1.8.12 /build/reproducible-path/chemps2-1.8.12/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests/CMakeFiles/test9.dir/DependInfo.cmake "--color="
make -f tests/CMakeFiles/test13.dir/build.make tests/CMakeFiles/test13.dir/depend
make -f tests/CMakeFiles/test14.dir/build.make tests/CMakeFiles/test14.dir/depend
make[4]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/chemps2-1.8.12 /build/reproducible-path/chemps2-1.8.12/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests/CMakeFiles/test10.dir/DependInfo.cmake "--color="
make[4]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/chemps2-1.8.12 /build/reproducible-path/chemps2-1.8.12/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests/CMakeFiles/test11.dir/DependInfo.cmake "--color="
make[4]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/chemps2-1.8.12 /build/reproducible-path/chemps2-1.8.12/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests/CMakeFiles/test13.dir/DependInfo.cmake "--color="
make[4]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/chemps2-1.8.12 /build/reproducible-path/chemps2-1.8.12/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests/CMakeFiles/test12.dir/DependInfo.cmake "--color="
make[4]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/chemps2-1.8.12 /build/reproducible-path/chemps2-1.8.12/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests/CMakeFiles/test14.dir/DependInfo.cmake "--color="
make[4]: Leaving directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
make -f tests/CMakeFiles/test2.dir/build.make tests/CMakeFiles/test2.dir/build
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make -f tests/CMakeFiles/test6.dir/build.make tests/CMakeFiles/test6.dir/build
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make -f tests/CMakeFiles/test1.dir/build.make tests/CMakeFiles/test1.dir/build
make[4]: Leaving directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
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make -f tests/CMakeFiles/test8.dir/build.make tests/CMakeFiles/test8.dir/build
make[4]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
make -f CheMPS2/CMakeFiles/chemps2-bin.dir/build.make CheMPS2/CMakeFiles/chemps2-bin.dir/build
make[4]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
make -f tests/CMakeFiles/test10.dir/build.make tests/CMakeFiles/test10.dir/build
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make -f tests/CMakeFiles/test11.dir/build.make tests/CMakeFiles/test11.dir/build
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make[4]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
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make[4]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
[ 68%] Building CXX object tests/CMakeFiles/test2.dir/tests/test2.cpp.o
[ 69%] Building CXX object tests/CMakeFiles/test6.dir/tests/test6.cpp.o
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -DUSING_CheMPS2 -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -isystem /usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -MD -MT tests/CMakeFiles/test2.dir/tests/test2.cpp.o -MF CMakeFiles/test2.dir/tests/test2.cpp.o.d -o CMakeFiles/test2.dir/tests/test2.cpp.o -c /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests/tests/test2.cpp
cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -DUSING_CheMPS2 -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -isystem /usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -MD -MT tests/CMakeFiles/test6.dir/tests/test6.cpp.o -MF CMakeFiles/test6.dir/tests/test6.cpp.o.d -o CMakeFiles/test6.dir/tests/test6.cpp.o -c /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests/tests/test6.cpp
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cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -DUSING_CheMPS2 -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -isystem /usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -MD -MT tests/CMakeFiles/test7.dir/tests/test7.cpp.o -MF CMakeFiles/test7.dir/tests/test7.cpp.o.d -o CMakeFiles/test7.dir/tests/test7.cpp.o -c /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests/tests/test7.cpp
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cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -DUSING_CheMPS2 -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -isystem /usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -MD -MT tests/CMakeFiles/test14.dir/tests/test14.cpp.o -MF CMakeFiles/test14.dir/tests/test14.cpp.o.d -o CMakeFiles/test14.dir/tests/test14.cpp.o -c /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests/tests/test14.cpp
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cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -DUSING_CheMPS2 -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -isystem /usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -MD -MT tests/CMakeFiles/test1.dir/tests/test1.cpp.o -MF CMakeFiles/test1.dir/tests/test1.cpp.o.d -o CMakeFiles/test1.dir/tests/test1.cpp.o -c /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests/tests/test1.cpp
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cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -DUSING_CheMPS2 -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -isystem /usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -MD -MT tests/CMakeFiles/test13.dir/tests/test13.cpp.o -MF CMakeFiles/test13.dir/tests/test13.cpp.o.d -o CMakeFiles/test13.dir/tests/test13.cpp.o -c /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/tests/tests/test13.cpp
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cd /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2 && /usr/bin/c++ -DCHEMPS2_VERSION="\"1.8.12 (2022-03-09)\"" -DH5_USE_110_API -DUSING_CheMPS2 -I/build/reproducible-path/chemps2-1.8.12/CheMPS2/include/chemps2 -isystem /usr/include/hdf5/serial -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -MD -MT CheMPS2/CMakeFiles/chemps2-bin.dir/executable.cpp.o -MF CMakeFiles/chemps2-bin.dir/executable.cpp.o.d -o CMakeFiles/chemps2-bin.dir/executable.cpp.o -c /build/reproducible-path/chemps2-1.8.12/CheMPS2/executable.cpp
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make[4]: Leaving directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
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make[4]: Leaving directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
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make[4]: Leaving directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
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[100%] Built target test7
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make[4]: Leaving directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
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/usr/bin/c++ -flto -g -O2 -ffile-prefix-map=/build/reproducible-path/chemps2-1.8.12=. -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fopenmp -O3 -DNDEBUG -Wl,-z,relro -Wl,-z,now -rdynamic -Wl,--dependency-file=CMakeFiles/chemps2-bin.dir/link.d "CMakeFiles/chemps2-bin.dir/executable.cpp.o" -o chemps2 -L/usr/lib/libeatmydata -Wl,-rpath,/usr/lib/libeatmydata:/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CheMPS2:/usr/lib/i386-linux-gnu/hdf5/serial: libchemps2.so.3 -llapack -lblas /usr/lib/i386-linux-gnu/hdf5/serial/libhdf5.so -lcrypto -lcurl -Wl,-Bstatic -lpthread -Wl,-Bdynamic -lsz -lz -Wl,-Bstatic -ldl -Wl,-Bdynamic -lm
make[4]: Leaving directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
[100%] Built target chemps2-bin
make[3]: Leaving directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
/usr/bin/cmake -E cmake_progress_start /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu/CMakeFiles 0
make[2]: Leaving directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
cd PyCheMPS2 && CPATH=../CheMPS2/include:/usr/include/hdf5/serial python3 setup.py build_ext -L ../obj-i686-linux-gnu/CheMPS2
/usr/lib/python3/dist-packages/Cython/Compiler/Main.py:381: FutureWarning: Cython directive 'language_level' not set, using '3str' for now (Py3). This has changed from earlier releases! File: /build/reproducible-path/chemps2-1.8.12/PyCheMPS2/PyCheMPS2.pyx
tree = Parsing.p_module(s, pxd, full_module_name)
Compiling PyCheMPS2.pyx because it changed.
[1/1] Cythonizing PyCheMPS2.pyx
In file included from /usr/lib/i386-linux-gnu/python3-numpy/numpy/_core/include/numpy/ndarraytypes.h:1913,
from /usr/lib/i386-linux-gnu/python3-numpy/numpy/_core/include/numpy/ndarrayobject.h:12,
from /usr/lib/i386-linux-gnu/python3-numpy/numpy/_core/include/numpy/arrayobject.h:5,
from PyCheMPS2.cpp:1287:
/usr/lib/i386-linux-gnu/python3-numpy/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 " \
| ^~~~~~~
make[1]: Leaving directory '/build/reproducible-path/chemps2-1.8.12'
debian/rules execute_after_dh_auto_build-indep
make[1]: Entering directory '/build/reproducible-path/chemps2-1.8.12'
# https://wiki.debian.org/Python/LibraryStyleGuide: info on sphinx-build
PYTHONPATH=. http_proxy='127.0.0.1:9' sphinx-build -N -b html \
-c obj-i686-linux-gnu/sphinx/ \
-D html_theme=default \
-D mathjax_path="/usr/share/javascript/mathjax/MathJax.js" sphinx/ build-sphinx/html
Running Sphinx v8.1.3
WARNING: Invalid configuration value found: 'language = None'. Update your configuration to a valid language code. Falling back to 'en' (English).
loading translations [en]... done
making output directory... done
Converting `source_suffix = '.rst'` to `source_suffix = {'.rst': 'restructuredtext'}`.
building [mo]: targets for 0 po files that are out of date
writing output...
building [html]: targets for 13 source files that are out of date
updating environment: [new config] 13 added, 0 changed, 0 removed
reading sources... [ 8%] caspt2
reading sources... [ 15%] dmrgscf
reading sources... [ 23%] dmrgscfcalcs
reading sources... [ 31%] handson
reading sources... [ 38%] index
reading sources... [ 46%] inoutput
reading sources... [ 54%] interfaces
reading sources... [ 62%] matrixelements
reading sources... [ 69%] method
reading sources... [ 77%] publications
reading sources... [ 85%] resources
reading sources... [ 92%] sourcecode
reading sources... [100%] symmetry
looking for now-outdated files... none found
pickling environment... done
checking consistency... done
preparing documents... done
copying assets...
copying static files...
Writing evaluated template result to /build/reproducible-path/chemps2-1.8.12/build-sphinx/html/_static/basic.css
Writing evaluated template result to /build/reproducible-path/chemps2-1.8.12/build-sphinx/html/_static/documentation_options.js
Writing evaluated template result to /build/reproducible-path/chemps2-1.8.12/build-sphinx/html/_static/language_data.js
Writing evaluated template result to /build/reproducible-path/chemps2-1.8.12/build-sphinx/html/_static/classic.css
Writing evaluated template result to /build/reproducible-path/chemps2-1.8.12/build-sphinx/html/_static/sidebar.js
copying static files: done
copying extra files...
copying extra files: done
copying assets: done
writing output... [ 8%] caspt2
writing output... [ 15%] dmrgscf
writing output... [ 23%] dmrgscfcalcs
writing output... [ 31%] handson
writing output... [ 38%] index
writing output... [ 46%] inoutput
writing output... [ 54%] interfaces
writing output... [ 62%] matrixelements
writing output... [ 69%] method
writing output... [ 77%] publications
writing output... [ 85%] resources
writing output... [ 92%] sourcecode
writing output... [100%] symmetry
generating indices... genindex done
highlighting module code...
writing additional pages... search done
copying images... [ 12%] handson_orbitals.png
copying images... [ 25%] handson_comparison.png
copying images... [ 38%] ExtrapolationN2reorder.png
copying images... [ 50%] Comparison.png
copying images... [ 62%] ComparisonN2.png
copying images... [ 75%] polyene_scaling.png
copying images... [ 88%] single_node_h2o.png
copying images... [100%] multi_node_h2o.png
dumping search index in English (code: en)... done
dumping object inventory... done
build succeeded, 1 warning.
The HTML pages are in build-sphinx/html.
# I know it's ugly, but sphinx splits strings at equality signs: http://svn.python.org/projects/doctools/trunk/sphinx/cmdline.py
cd build-sphinx/html && sed -i "s/MathJax.js/MathJax.js?config=TeX-AMS-MML_HTMLorMML/" *.html
# Solving the complaints from lintian about jquery.js & underscore.js
cd build-sphinx/html && sed -i "s/_static\/jquery.js/\/usr\/share\/javascript\/jquery\/jquery.js/" *.html
cd build-sphinx/html && sed -i "s/_static\/underscore.js/\/usr\/share\/javascript\/underscore\/underscore.js/" *.html
cd build-sphinx/html/_static && rm -f jquery*.js underscore*.js
make[1]: Leaving directory '/build/reproducible-path/chemps2-1.8.12'
debian/rules override_dh_auto_test
make[1]: Entering directory '/build/reproducible-path/chemps2-1.8.12'
cd obj-i686-linux-gnu/ && ctest -R "^test3|^test5|^test8"
Test project /build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu
Start 3: test3
1/3 Test #3: test3 ............................ Passed 7.70 sec
Start 5: test5
2/3 Test #5: test5 ............................ Passed 5.79 sec
Start 8: test8
3/3 Test #8: test8 ............................ Passed 14.92 sec
100% tests passed, 0 tests failed out of 3
Total Test time (real) = 28.42 sec
cd PyCheMPS2/tests && PYTHONPATH=../.././PyCheMPS2/build/lib.linux-x86_64-cpython-313:.. \
LD_LIBRARY_PATH=../../obj-i686-linux-gnu/CheMPS2:/usr/lib/i386-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 -99.6828453787493
Stats: nIt(DAVIDSON) = 15
Energy at sites (7, 8) is -106.85195017206
Stats: nIt(DAVIDSON) = 60
Energy at sites (6, 7) is -106.877611121423
Stats: nIt(DAVIDSON) = 75
Energy at sites (5, 6) is -106.906356968399
Stats: nIt(DAVIDSON) = 39
Energy at sites (4, 5) is -107.632223109767
Stats: nIt(DAVIDSON) = 23
Energy at sites (3, 4) is -107.647926883865
Stats: nIt(DAVIDSON) = 1
Energy at sites (2, 3) is -107.647926883865
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -107.647926883866
******************************************************************
*** Information on left sweep 0 of instruction 0:
*** Elapsed wall time = 1.283055 seconds
*** |--> S.join = 0.016947 seconds
*** |--> S.solve = 1.144611 seconds
*** |--> S.split = 0.036428 seconds
*** |--> Tensor update = 0.084158 seconds
*** |--> create = 0.021154 seconds
*** |--> destroy = 0.001177 seconds
*** |--> disk write = 0.011844 seconds
*** |--> disk read = 0.006704 seconds
*** |--> calc = 0.043244 seconds
*** Disk write bandwidth = 49.4731837372166 MB/s
*** Disk read bandwidth = 87.7004819155308 MB/s
*** Minimum energy = -107.647926883866
*** Maximum discarded weight = 0
******************************************************************
Stats: nIt(DAVIDSON) = 1
Energy at sites (0, 1) is -107.647926883865
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -107.647926883866
Stats: nIt(DAVIDSON) = 1
Energy at sites (2, 3) is -107.647926883865
Stats: nIt(DAVIDSON) = 1
Energy at sites (3, 4) is -107.647926883866
Stats: nIt(DAVIDSON) = 9
Energy at sites (4, 5) is -107.647941248758
Stats: nIt(DAVIDSON) = 8
Energy at sites (5, 6) is -107.648250229205
Stats: nIt(DAVIDSON) = 1
Energy at sites (6, 7) is -107.648250229205
Stats: nIt(DAVIDSON) = 1
Energy at sites (7, 8) is -107.648250229205
******************************************************************
*** Information on right sweep 0 of instruction 0:
*** Elapsed wall time = 0.170154 seconds
*** |--> S.join = 0.014328 seconds
*** |--> S.solve = 0.0647920000000001 seconds
*** |--> S.split = 0.019977 seconds
*** |--> Tensor update = 0.070826 seconds
*** |--> create = 0.020629 seconds
*** |--> destroy = 0.001292 seconds
*** |--> disk write = 0.010872 seconds
*** |--> disk read = 0.006469 seconds
*** |--> calc = 0.031536 seconds
*** Disk write bandwidth = 54.0787371929469 MB/s
*** Disk read bandwidth = 90.5797477482754 MB/s
*** Minimum energy = -107.648250229205
*** Maximum discarded weight = 0
*** Energy difference with respect to previous leftright sweep = 107.648250229205
******************************************************************
Stats: nIt(DAVIDSON) = 1
Energy at sites (8, 9) is -107.648250229205
Stats: nIt(DAVIDSON) = 1
Energy at sites (7, 8) is -107.648250229205
Stats: nIt(DAVIDSON) = 1
Energy at sites (6, 7) is -107.648250229205
Stats: nIt(DAVIDSON) = 1
Energy at sites (5, 6) is -107.648250229205
Stats: nIt(DAVIDSON) = 7
Energy at sites (4, 5) is -107.648250870074
Stats: nIt(DAVIDSON) = 4
Energy at sites (3, 4) is -107.648250971645
Stats: nIt(DAVIDSON) = 1
Energy at sites (2, 3) is -107.648250971645
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -107.648250971645
******************************************************************
*** Information on left sweep 1 of instruction 0:
*** Elapsed wall time = 0.313366 seconds
*** |--> S.join = 0.014857 seconds
*** |--> S.solve = 0.171588 seconds
*** |--> S.split = 0.038493 seconds
*** |--> Tensor update = 0.088275 seconds
*** |--> create = 0.021344 seconds
*** |--> destroy = 0.001261 seconds
*** |--> disk write = 0.011219 seconds
*** |--> disk read = 0.006361 seconds
*** |--> calc = 0.048059 seconds
*** Disk write bandwidth = 52.2292885447539 MB/s
*** Disk read bandwidth = 92.4294970541925 MB/s
*** Minimum energy = -107.648250971645
*** Maximum discarded weight = 0
******************************************************************
Stats: nIt(DAVIDSON) = 1
Energy at sites (0, 1) is -107.648250971645
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -107.648250971645
Stats: nIt(DAVIDSON) = 1
Energy at sites (2, 3) is -107.648250971645
Stats: nIt(DAVIDSON) = 1
Energy at sites (3, 4) is -107.648250971645
Stats: nIt(DAVIDSON) = 2
Energy at sites (4, 5) is -107.648250971749
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 = 0.285601 seconds
*** |--> S.join = 0.014814 seconds
*** |--> S.solve = 0.125496 seconds
*** |--> S.split = 0.044568 seconds
*** |--> Tensor update = 0.100463 seconds
*** |--> create = 0.021522 seconds
*** |--> destroy = 0.001237 seconds
*** |--> disk write = 0.012328 seconds
*** |--> disk read = 0.006543 seconds
*** |--> calc = 0.058802 seconds
*** Disk write bandwidth = 47.6917610935852 MB/s
*** Disk read bandwidth = 89.5553092134485 MB/s
*** Minimum energy = -107.648250973994
*** Maximum discarded weight = 0
*** Energy difference with respect to previous leftright sweep = 7.44788877682367e-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 -107.648250973996
Stats: nIt(DAVIDSON) = 8
Energy at sites (7, 8) is -107.648250973997
Stats: nIt(DAVIDSON) = 10
Energy at sites (6, 7) is -107.648250974
Stats: nIt(DAVIDSON) = 9
Energy at sites (5, 6) is -107.648250974
Stats: nIt(DAVIDSON) = 12
Energy at sites (4, 5) is -107.648250974006
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 -107.648250974013
******************************************************************
*** Information on left sweep 0 of instruction 1:
*** Elapsed wall time = 0.751966 seconds
*** |--> S.join = 0.01819 seconds
*** |--> S.solve = 0.344951 seconds
*** |--> S.split = 0.044423 seconds
*** |--> Tensor update = 0.34365 seconds
*** |--> create = 0.022933 seconds
*** |--> destroy = 0.001192 seconds
*** |--> disk write = 0.262521 seconds
*** |--> disk read = 0.008381 seconds
*** |--> calc = 0.048584 seconds
*** Disk write bandwidth = 2.23205148610433 MB/s
*** Disk read bandwidth = 70.1520141703518 MB/s
*** Minimum energy = -107.648250974013
*** 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 -107.648250974013
Stats: nIt(DAVIDSON) = 1
Energy at sites (2, 3) is -107.648250974013
Stats: nIt(DAVIDSON) = 1
Energy at sites (3, 4) is -107.648250974013
Stats: nIt(DAVIDSON) = 8
Energy at sites (4, 5) is -107.648250974014
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 = 0.487787 seconds
*** |--> S.join = 0.016591 seconds
*** |--> S.solve = 0.264867 seconds
*** |--> S.split = 0.070698 seconds
*** |--> Tensor update = 0.134817 seconds
*** |--> create = 0.021439 seconds
*** |--> destroy = 0.001318 seconds
*** |--> disk write = 0.011797 seconds
*** |--> disk read = 0.006603 seconds
*** |--> calc = 0.093619 seconds
*** Disk write bandwidth = 49.8384361076307 MB/s
*** Disk read bandwidth = 88.7415399339079 MB/s
*** Minimum energy = -107.648250974014
*** Maximum discarded weight = 0
*** Energy difference with respect to previous leftright sweep = 1.98951966012828e-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) = -107.648250974014
NOON of irrep Ag = [ 1.9999953044428 , 1.99487994124924 , 1.98267954064353 ].
NOON of irrep B2g = [ 0.0748715522396103 ].
NOON of irrep B3g = [ 0.0748715522749104 ].
NOON of irrep B1u = [ 1.9999968183922 , 1.98658242717678 , 0.018807971246005 ].
NOON of irrep B2u = [ 1.93365744620166 ].
NOON of irrep B3u = [ 1.93365744613325 ].
Single-orbital entropies (Hamiltonian index order is used!) = [ 0.000131009426416415 , 0.0515866772714123 , 0.0764971091761531 , 0.257716818825321 , 0.25771681889807 , 8.47155299862511e-05 , 0.0462800402748646 , 0.100736303644097 , 0.241506019575085 , 0.241506019701631 ].
Idistance(0) = 1.30939331185574
Idistance(1) = 5.42402999479575
Idistance(2) = 26.7355487977214
***************************************************
*** Timing information 2-RDM and Correlations ***
***************************************************
*** Elapsed wall time = 0.262272 seconds
*** |--> MPS gauge change = 0.065902 seconds
*** |--> Diagram calc = 0.016727 seconds
*** |--> Tensor update = 0.178017 seconds
*** |--> create = 0.048644 seconds
*** |--> destroy = 0.002898 seconds
*** |--> disk write = 0.025167 seconds
*** |--> disk read = 0.015847 seconds
*** |--> calc = 0.085338 seconds
*** Disk write bandwidth = 47.3090973003461 MB/s
*** Disk read bandwidth = 75.1327097720586 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 = 0.01224 seconds
FCI::matvec : Wall time = 0.016692 seconds
FCI::matvec : Wall time = 0.015666 seconds
FCI::matvec : Wall time = 0.041441 seconds
FCI::matvec : Wall time = 0.013392 seconds
FCI::matvec : Wall time = 0.012387 seconds
FCI::matvec : Wall time = 0.030361 seconds
FCI::matvec : Wall time = 0.014371 seconds
FCI::matvec : Wall time = 0.013761 seconds
FCI::matvec : Wall time = 0.016321 seconds
FCI::matvec : Wall time = 0.02219 seconds
FCI::matvec : Wall time = 0.050511 seconds
FCI::matvec : Wall time = 0.019705 seconds
FCI::matvec : Wall time = 0.043544 seconds
FCI::matvec : Wall time = 0.013696 seconds
FCI::matvec : Wall time = 0.020419 seconds
FCI::matvec : Wall time = 0.01643 seconds
FCI::matvec : Wall time = 0.071887 seconds
FCI::GSDavidson : Converged ground state energy = -107.648250974014
FCI::CalcSpinSquared : For intended spin 0 the measured S(S+1) = -1.05134898297818e-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) = 12
Energy at sites (8, 9) is -100.895389007726
Stats: nIt(DAVIDSON) = 28
Energy at sites (7, 8) is -106.336078085652
Stats: nIt(DAVIDSON) = 40
Energy at sites (6, 7) is -106.383117804545
Stats: nIt(DAVIDSON) = 63
Energy at sites (5, 6) is -107.317964210117
Stats: nIt(DAVIDSON) = 52
Energy at sites (4, 5) is -107.325596461179
Stats: nIt(DAVIDSON) = 21
Energy at sites (3, 4) is -107.328763309151
Stats: nIt(DAVIDSON) = 9
Energy at sites (2, 3) is -107.328764693172
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -107.328764693172
******************************************************************
*** Information on left sweep 0 of instruction 0:
*** Elapsed wall time = 0.94904 seconds
*** |--> S.join = 0.016268 seconds
*** |--> S.solve = 0.86121 seconds
*** |--> S.split = 0.002559 seconds
*** |--> Tensor update = 0.068212 seconds
*** |--> create = 0.024048 seconds
*** |--> destroy = 0.001208 seconds
*** |--> disk write = 0.012188 seconds
*** |--> disk read = 0.006623 seconds
*** |--> calc = 0.024102 seconds
*** Disk write bandwidth = 69.3161917155322 MB/s
*** Disk read bandwidth = 127.012197225813 MB/s
*** Minimum energy = -107.328764693172
*** Maximum discarded weight = 0
******************************************************************
Stats: nIt(DAVIDSON) = 1
Energy at sites (0, 1) is -107.328764693172
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -107.328764693172
Stats: nIt(DAVIDSON) = 1
Energy at sites (2, 3) is -107.328764693172
Stats: nIt(DAVIDSON) = 4
Energy at sites (3, 4) is -107.328764694584
Stats: nIt(DAVIDSON) = 7
Energy at sites (4, 5) is -107.328767020912
Stats: nIt(DAVIDSON) = 7
Energy at sites (5, 6) is -107.328768891538
Stats: nIt(DAVIDSON) = 1
Energy at sites (6, 7) is -107.328768891538
Stats: nIt(DAVIDSON) = 1
Energy at sites (7, 8) is -107.328768891538
******************************************************************
*** Information on right sweep 0 of instruction 0:
*** Elapsed wall time = 0.1949 seconds
*** |--> S.join = 0.012111 seconds
*** |--> S.solve = 0.104379 seconds
*** |--> S.split = 0.016106 seconds
*** |--> Tensor update = 0.061897 seconds
*** |--> create = 0.024407 seconds
*** |--> destroy = 0.001228 seconds
*** |--> disk write = 0.011842 seconds
*** |--> disk read = 0.00659 seconds
*** |--> calc = 0.017798 seconds
*** Disk write bandwidth = 71.0354485920083 MB/s
*** Disk read bandwidth = 128.198140307877 MB/s
*** Minimum energy = -107.328768891538
*** Maximum discarded weight = 0
*** Energy difference with respect to previous leftright sweep = 107.328768891538
******************************************************************
Stats: nIt(DAVIDSON) = 1
Energy at sites (8, 9) is -107.328768891538
Stats: nIt(DAVIDSON) = 1
Energy at sites (7, 8) is -107.328768891538
Stats: nIt(DAVIDSON) = 1
Energy at sites (6, 7) is -107.328768891538
Stats: nIt(DAVIDSON) = 1
Energy at sites (5, 6) is -107.328768891538
Stats: nIt(DAVIDSON) = 3
Energy at sites (4, 5) is -107.328768891998
Stats: nIt(DAVIDSON) = 3
Energy at sites (3, 4) is -107.328768897978
Stats: nIt(DAVIDSON) = 1
Energy at sites (2, 3) is -107.328768897978
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -107.328768897978
******************************************************************
*** Information on left sweep 1 of instruction 0:
*** Elapsed wall time = 0.084957 seconds
*** |--> S.join = 0.010595 seconds
*** |--> S.solve = 0.016621 seconds
*** |--> S.split = 0.002352 seconds
*** |--> Tensor update = 0.054682 seconds
*** |--> create = 0.024002 seconds
*** |--> destroy = 0.001375 seconds
*** |--> disk write = 0.011452 seconds
*** |--> disk read = 0.00652 seconds
*** |--> calc = 0.011299 seconds
*** Disk write bandwidth = 73.7710220598067 MB/s
*** Disk read bandwidth = 129.018678255608 MB/s
*** Minimum energy = -107.328768897978
*** Maximum discarded weight = 0
******************************************************************
Stats: nIt(DAVIDSON) = 1
Energy at sites (0, 1) is -107.328768897978
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -107.328768897978
Stats: nIt(DAVIDSON) = 1
Energy at sites (2, 3) is -107.328768897978
Stats: nIt(DAVIDSON) = 1
Energy at sites (3, 4) is -107.328768897978
Stats: nIt(DAVIDSON) = 2
Energy at sites (4, 5) is -107.328768898014
Stats: nIt(DAVIDSON) = 1
Energy at sites (5, 6) is -107.328768898014
Stats: nIt(DAVIDSON) = 1
Energy at sites (6, 7) is -107.328768898014
Stats: nIt(DAVIDSON) = 1
Energy at sites (7, 8) is -107.328768898014
******************************************************************
*** Information on right sweep 1 of instruction 0:
*** Elapsed wall time = 0.174656 seconds
*** |--> S.join = 0.010838 seconds
*** |--> S.solve = 0.06759 seconds
*** |--> S.split = 0.026094 seconds
*** |--> Tensor update = 0.069373 seconds
*** |--> create = 0.024508 seconds
*** |--> destroy = 0.001213 seconds
*** |--> disk write = 0.011426 seconds
*** |--> disk read = 0.006444 seconds
*** |--> calc = 0.025748 seconds
*** Disk write bandwidth = 73.6217208320111 MB/s
*** Disk read bandwidth = 131.102691593561 MB/s
*** Minimum energy = -107.328768898014
*** Maximum discarded weight = 0
*** Energy difference with respect to previous leftright sweep = 6.47617071081186e-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 = -107.328768898014
*** Minimum energy encountered during the last sweep = -107.328768898014
*** Maximum discarded weight during the last sweep = 0
******************************************************************
Stats: nIt(DAVIDSON) = 8
Energy at sites (8, 9) is -107.328768898016
Stats: nIt(DAVIDSON) = 10
Energy at sites (7, 8) is -107.328768898022
Stats: nIt(DAVIDSON) = 14
Energy at sites (6, 7) is -107.328768898029
Stats: nIt(DAVIDSON) = 13
Energy at sites (5, 6) is -107.328768898029
Stats: nIt(DAVIDSON) = 13
Energy at sites (4, 5) is -107.32876889803
Stats: nIt(DAVIDSON) = 15
Energy at sites (3, 4) is -107.328768898032
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 = 0.243197 seconds
*** |--> S.join = 0.011293 seconds
*** |--> S.solve = 0.169368 seconds
*** |--> S.split = 0.002958 seconds
*** |--> Tensor update = 0.05942 seconds
*** |--> create = 0.024141 seconds
*** |--> destroy = 0.001307 seconds
*** |--> disk write = 0.012153 seconds
*** |--> disk read = 0.006599 seconds
*** |--> calc = 0.015187 seconds
*** Disk write bandwidth = 69.515818697351 MB/s
*** Disk read bandwidth = 127.474129750957 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) = 10
Energy at sites (5, 6) is -107.328768898033
Stats: nIt(DAVIDSON) = 1
Energy at sites (6, 7) is -107.328768898033
Stats: nIt(DAVIDSON) = 1
Energy at sites (7, 8) is -107.328768898033
******************************************************************
*** Information on right sweep 0 of instruction 1:
*** Elapsed wall time = 0.204403 seconds
*** |--> S.join = 0.008215 seconds
*** |--> S.solve = 0.119882 seconds
*** |--> S.split = 0.013141 seconds
*** |--> Tensor update = 0.06299 seconds
*** |--> create = 0.024289 seconds
*** |--> destroy = 0.001262 seconds
*** |--> disk write = 0.012632 seconds
*** |--> disk read = 0.006738 seconds
*** |--> calc = 0.018035 seconds
*** Disk write bandwidth = 66.5929213288919 MB/s
*** Disk read bandwidth = 125.382271390458 MB/s
*** Minimum energy = -107.328768898033
*** Maximum discarded weight = 0
*** Energy difference with respect to previous leftright sweep = 1.8360424292041e-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 = [ 1.99999672241166 , 1.99571463011548 , 1.98497373608242 ].
NOON of irrep B2g = [ 0.538989905180748 ].
NOON of irrep B3g = [ 0.538989904900489 ].
NOON of irrep B1u = [ 1.99999702947242 , 1.99149890562947 , 0.0194690668292564 ].
NOON of irrep B2u = [ 1.46518504983043 ].
NOON of irrep B3u = [ 1.46518504954763 ].
Single-orbital entropies (Hamiltonian index order is used!) = [ 0.000105862735528467 , 0.0587089374925683 , 0.0554792807929579 , 1.11957630010935 , 1.11957629995862 , 8.52797484388311e-05 , 0.0421718621052098 , 0.105000352878041 , 1.11261995844809 , 1.11261995860257 ].
Idistance(0) = 4.60188108175708
Idistance(1) = 17.7825010802424
Idistance(2) = 85.6947708280033
***************************************************
*** Timing information 2-RDM and Correlations ***
***************************************************
*** Elapsed wall time = 0.183234 seconds
*** |--> MPS gauge change = 0.029996 seconds
*** |--> Diagram calc = 0.016393 seconds
*** |--> Tensor update = 0.135659 seconds
*** |--> create = 0.056924 seconds
*** |--> destroy = 0.003046 seconds
*** |--> disk write = 0.026137 seconds
*** |--> disk read = 0.01579 seconds
*** |--> calc = 0.033629 seconds
*** Disk write bandwidth = 65.5371324467888 MB/s
*** Disk read bandwidth = 108.482839186936 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 = 0.021888 seconds
FCI::matvec : Wall time = 0.019563 seconds
FCI::matvec : Wall time = 0.011631 seconds
FCI::matvec : Wall time = 0.013088 seconds
FCI::matvec : Wall time = 0.058065 seconds
FCI::matvec : Wall time = 0.014096 seconds
FCI::matvec : Wall time = 0.014361 seconds
FCI::matvec : Wall time = 0.014697 seconds
FCI::matvec : Wall time = 0.018198 seconds
FCI::matvec : Wall time = 0.013352 seconds
FCI::matvec : Wall time = 0.019149 seconds
FCI::matvec : Wall time = 0.014467 seconds
FCI::matvec : Wall time = 0.034895 seconds
FCI::matvec : Wall time = 0.014884 seconds
FCI::matvec : Wall time = 0.01446 seconds
FCI::matvec : Wall time = 0.014505 seconds
FCI::matvec : Wall time = 0.014965 seconds
FCI::GSDavidson : Converged ground state energy = -107.328768898032
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 -103.979109854095
Stats: nIt(DAVIDSON) = 17
Energy at sites (7, 8) is -105.669558146583
Stats: nIt(DAVIDSON) = 27
Energy at sites (6, 7) is -106.994496432095
Stats: nIt(DAVIDSON) = 16
Energy at sites (5, 6) is -106.994852558359
Stats: nIt(DAVIDSON) = 20
Energy at sites (4, 5) is -106.997036640773
Stats: nIt(DAVIDSON) = 17
Energy at sites (3, 4) is -106.999345060003
Stats: nIt(DAVIDSON) = 13
Energy at sites (2, 3) is -107.007876909537
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -107.007876909537
******************************************************************
*** Information on left sweep 0 of instruction 0:
*** Elapsed wall time = 0.122019 seconds
*** |--> S.join = 0.009041 seconds
*** |--> S.solve = 0.071841 seconds
*** |--> S.split = 0.001643 seconds
*** |--> Tensor update = 0.039348 seconds
*** |--> create = 0.019875 seconds
*** |--> destroy = 0.001218 seconds
*** |--> disk write = 0.009909 seconds
*** |--> disk read = 0.006262 seconds
*** |--> calc = 0.002055 seconds
*** Disk write bandwidth = 19.7083067732774 MB/s
*** Disk read bandwidth = 31.0134522186153 MB/s
*** Minimum energy = -107.007876909537
*** Maximum discarded weight = 0
******************************************************************
Stats: nIt(DAVIDSON) = 1
Energy at sites (0, 1) is -107.007876909537
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -107.007876909537
Stats: nIt(DAVIDSON) = 1
Energy at sites (2, 3) is -107.007876909537
Stats: nIt(DAVIDSON) = 6
Energy at sites (3, 4) is -107.007877299338
Stats: nIt(DAVIDSON) = 11
Energy at sites (4, 5) is -107.007880725794
Stats: nIt(DAVIDSON) = 11
Energy at sites (5, 6) is -107.00792033159
Stats: nIt(DAVIDSON) = 1
Energy at sites (6, 7) is -107.00792033159
Stats: nIt(DAVIDSON) = 1
Energy at sites (7, 8) is -107.00792033159
******************************************************************
*** Information on right sweep 0 of instruction 0:
*** Elapsed wall time = 0.095244 seconds
*** |--> S.join = 0.010526 seconds
*** |--> S.solve = 0.041795 seconds
*** |--> S.split = 0.001577 seconds
*** |--> Tensor update = 0.041206 seconds
*** |--> create = 0.019817 seconds
*** |--> destroy = 0.001262 seconds
*** |--> disk write = 0.010363 seconds
*** |--> disk read = 0.006489 seconds
*** |--> calc = 0.003252 seconds
*** Disk write bandwidth = 18.7403491067228 MB/s
*** Disk read bandwidth = 30.0954864873488 MB/s
*** Minimum energy = -107.00792033159
*** Maximum discarded weight = 0
*** Energy difference with respect to previous leftright sweep = 107.00792033159
******************************************************************
Stats: nIt(DAVIDSON) = 1
Energy at sites (8, 9) is -107.00792033159
Stats: nIt(DAVIDSON) = 1
Energy at sites (7, 8) is -107.00792033159
Stats: nIt(DAVIDSON) = 1
Energy at sites (6, 7) is -107.00792033159
Stats: nIt(DAVIDSON) = 1
Energy at sites (5, 6) is -107.00792033159
Stats: nIt(DAVIDSON) = 3
Energy at sites (4, 5) is -107.007920345524
Stats: nIt(DAVIDSON) = 5
Energy at sites (3, 4) is -107.00792040286
Stats: nIt(DAVIDSON) = 3
Energy at sites (2, 3) is -107.007920596637
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -107.007920596637
******************************************************************
*** Information on left sweep 1 of instruction 0:
*** Elapsed wall time = 0.179667 seconds
*** |--> S.join = 0.009577 seconds
*** |--> S.solve = 0.098959 seconds
*** |--> S.split = 0.018611 seconds
*** |--> Tensor update = 0.052374 seconds
*** |--> create = 0.019781 seconds
*** |--> destroy = 0.001229 seconds
*** |--> disk write = 0.010382 seconds
*** |--> disk read = 0.006342 seconds
*** |--> calc = 0.014612 seconds
*** Disk write bandwidth = 18.8104037580819 MB/s
*** Disk read bandwidth = 30.6222386933095 MB/s
*** Minimum energy = -107.007920596637
*** Maximum discarded weight = 0
******************************************************************
Stats: nIt(DAVIDSON) = 1
Energy at sites (0, 1) is -107.007920596637
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -107.007920596637
Stats: nIt(DAVIDSON) = 1
Energy at sites (2, 3) is -107.007920596636
Stats: nIt(DAVIDSON) = 2
Energy at sites (3, 4) is -107.007920596756
Stats: nIt(DAVIDSON) = 2
Energy at sites (4, 5) is -107.007920596784
Stats: nIt(DAVIDSON) = 3
Energy at sites (5, 6) is -107.00792059938
Stats: nIt(DAVIDSON) = 1
Energy at sites (6, 7) is -107.00792059938
Stats: nIt(DAVIDSON) = 1
Energy at sites (7, 8) is -107.00792059938
******************************************************************
*** Information on right sweep 1 of instruction 0:
*** Elapsed wall time = 0.059666 seconds
*** |--> S.join = 0.009093 seconds
*** |--> S.solve = 0.008896 seconds
*** |--> S.split = 0.00165 seconds
*** |--> Tensor update = 0.039889 seconds
*** |--> create = 0.019829 seconds
*** |--> destroy = 0.001222 seconds
*** |--> disk write = 0.010203 seconds
*** |--> disk read = 0.006469 seconds
*** |--> calc = 0.002142 seconds
*** Disk write bandwidth = 19.0342289319777 MB/s
*** Disk read bandwidth = 30.1885317385077 MB/s
*** Minimum energy = -107.00792059938
*** Maximum discarded weight = 0
*** Energy difference with respect to previous leftright sweep = 2.67790511543353e-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 = -107.00792059938
*** Minimum energy encountered during the last sweep = -107.00792059938
*** Maximum discarded weight during the last sweep = 0
******************************************************************
Stats: nIt(DAVIDSON) = 7
Energy at sites (8, 9) is -107.007920599393
Stats: nIt(DAVIDSON) = 8
Energy at sites (7, 8) is -107.007920599395
Stats: nIt(DAVIDSON) = 14
Energy at sites (6, 7) is -107.007920599398
Stats: nIt(DAVIDSON) = 12
Energy at sites (5, 6) is -107.007920599398
Stats: nIt(DAVIDSON) = 12
Energy at sites (4, 5) is -107.007920599398
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 = 0.189778 seconds
*** |--> S.join = 0.014213 seconds
*** |--> S.solve = 0.113082 seconds
*** |--> S.split = 0.010237 seconds
*** |--> Tensor update = 0.051749 seconds
*** |--> create = 0.018903 seconds
*** |--> destroy = 0.001211 seconds
*** |--> disk write = 0.010118 seconds
*** |--> disk read = 0.006384 seconds
*** |--> calc = 0.015097 seconds
*** Disk write bandwidth = 19.3012069397516 MB/s
*** Disk read bandwidth = 30.420776596643 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) = 7
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 = 0.123029 seconds
*** |--> S.join = 0.011197 seconds
*** |--> S.solve = 0.065167 seconds
*** |--> S.split = 0.002062 seconds
*** |--> Tensor update = 0.044162 seconds
*** |--> create = 0.019864 seconds
*** |--> destroy = 0.00121 seconds
*** |--> disk write = 0.010417 seconds
*** |--> disk read = 0.006516 seconds
*** |--> calc = 0.00612 seconds
*** Disk write bandwidth = 18.6432022456531 MB/s
*** Disk read bandwidth = 29.9707814328432 MB/s
*** Minimum energy = -107.007920599439
*** Maximum discarded weight = 0
*** Energy difference with respect to previous leftright sweep = 5.85771431360627e-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) = -107.007920599438
NOON of irrep Ag = [ 1.99999761728787 , 1.99817458702864 , 1.99099529635278 ].
NOON of irrep B2g = [ 0.999157311018239 ].
NOON of irrep B3g = [ 0.999157310935511 ].
NOON of irrep B1u = [ 1.9999976339814 , 1.99356772577953 , 0.0151843203819756 ].
NOON of irrep B2u = [ 1.00188409866517 ].
NOON of irrep B3u = [ 1.00188409856888 ].
Single-orbital entropies (Hamiltonian index order is used!) = [ 4.85624825641966e-05 , 0.0439795124693612 , 0.0191227049267903 , 0.710073262911536 , 0.710073263516959 , 0.000114194275841605 , 0.0501988277925959 , 0.0847680570657043 , 0.70939318668783 , 0.709393186110655 ].
Idistance(0) = 1.96740724039029
Idistance(1) = 7.24682976582427
Idistance(2) = 34.6048709831239
***************************************************
*** Timing information 2-RDM and Correlations ***
***************************************************
*** Elapsed wall time = 0.193236 seconds
*** |--> MPS gauge change = 0.049532 seconds
*** |--> Diagram calc = 0.012886 seconds
*** |--> Tensor update = 0.129588 seconds
*** |--> create = 0.0462290000000001 seconds
*** |--> destroy = 0.002863 seconds
*** |--> disk write = 0.024821 seconds
*** |--> disk read = 0.015323 seconds
*** |--> calc = 0.04023 seconds
*** Disk write bandwidth = 16.486143817074 MB/s
*** Disk read bandwidth = 26.7051214307638 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 = 0.015506 seconds
FCI::matvec : Wall time = 0.011293 seconds
FCI::matvec : Wall time = 0.011344 seconds
FCI::matvec : Wall time = 0.011106 seconds
FCI::matvec : Wall time = 0.009179 seconds
FCI::matvec : Wall time = 0.012129 seconds
FCI::matvec : Wall time = 0.015993 seconds
FCI::matvec : Wall time = 0.01576 seconds
FCI::matvec : Wall time = 0.010835 seconds
FCI::matvec : Wall time = 0.009273 seconds
FCI::matvec : Wall time = 0.135364 seconds
FCI::matvec : Wall time = 0.849576 seconds
FCI::GSDavidson : Converged ground state energy = -107.007920599439
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) = 16
Energy at sites (8, 9) is -102.765778179911
Stats: nIt(DAVIDSON) = 23
Energy at sites (7, 8) is -105.793581553034
Stats: nIt(DAVIDSON) = 49
Energy at sites (6, 7) is -105.904401853678
Stats: nIt(DAVIDSON) = 43
Energy at sites (5, 6) is -105.905615666678
Stats: nIt(DAVIDSON) = 47
Energy at sites (4, 5) is -106.125397591066
Stats: nIt(DAVIDSON) = 45
Energy at sites (3, 4) is -106.180357936889
Stats: nIt(DAVIDSON) = 4
Energy at sites (2, 3) is -106.180358119333
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -106.180358119333
******************************************************************
*** Information on left sweep 0 of instruction 0:
*** Elapsed wall time = 1.348977 seconds
*** |--> S.join = 0.016823 seconds
*** |--> S.solve = 1.172225 seconds
*** |--> S.split = 0.048924 seconds
*** |--> Tensor update = 0.109866 seconds
*** |--> create = 0.019853 seconds
*** |--> destroy = 0.001316 seconds
*** |--> disk write = 0.011931 seconds
*** |--> disk read = 0.00722 seconds
*** |--> calc = 0.069505 seconds
*** Disk write bandwidth = 16.9188266287664 MB/s
*** Disk read bandwidth = 27.808192033847 MB/s
*** Minimum energy = -106.180358119333
*** Maximum discarded weight = 0
******************************************************************
Stats: nIt(DAVIDSON) = 1
Energy at sites (0, 1) is -106.180358119333
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -106.180358119333
Stats: nIt(DAVIDSON) = 1
Energy at sites (2, 3) is -106.180358119333
Stats: nIt(DAVIDSON) = 2
Energy at sites (3, 4) is -106.180358119357
Stats: nIt(DAVIDSON) = 10
Energy at sites (4, 5) is -106.18041772056
Stats: nIt(DAVIDSON) = 11
Energy at sites (5, 6) is -106.191431220844
Stats: nIt(DAVIDSON) = 2
Energy at sites (6, 7) is -106.191431221783
Stats: nIt(DAVIDSON) = 1
Energy at sites (7, 8) is -106.191431221783
******************************************************************
*** Information on right sweep 0 of instruction 0:
*** Elapsed wall time = 0.449808 seconds
*** |--> S.join = 0.016563 seconds
*** |--> S.solve = 0.266408 seconds
*** |--> S.split = 0.055767 seconds
*** |--> Tensor update = 0.110895 seconds
*** |--> create = 0.020752 seconds
*** |--> destroy = 0.001227 seconds
*** |--> disk write = 0.010998 seconds
*** |--> disk read = 0.007305 seconds
*** |--> calc = 0.07058 seconds
*** Disk write bandwidth = 18.2556052449877 MB/s
*** Disk read bandwidth = 27.6329254630818 MB/s
*** Minimum energy = -106.191431221783
*** Maximum discarded weight = 0
*** Energy difference with respect to previous leftright sweep = 106.191431221783
******************************************************************
Stats: nIt(DAVIDSON) = 1
Energy at sites (8, 9) is -106.191431221783
Stats: nIt(DAVIDSON) = 1
Energy at sites (7, 8) is -106.191431221783
Stats: nIt(DAVIDSON) = 1
Energy at sites (6, 7) is -106.191431221783
Stats: nIt(DAVIDSON) = 1
Energy at sites (5, 6) is -106.191431221783
Stats: nIt(DAVIDSON) = 10
Energy at sites (4, 5) is -106.191461019986
Stats: nIt(DAVIDSON) = 7
Energy at sites (3, 4) is -106.191465728143
Stats: nIt(DAVIDSON) = 4
Energy at sites (2, 3) is -106.191465740481
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -106.191465740481
******************************************************************
*** Information on left sweep 1 of instruction 0:
*** Elapsed wall time = 0.059007 seconds
*** |--> S.join = 0.00221 seconds
*** |--> S.solve = 0.010657 seconds
*** |--> S.split = 0.001517 seconds
*** |--> Tensor update = 0.044445 seconds
*** |--> create = 0.020049 seconds
*** |--> destroy = 0.001178 seconds
*** |--> disk write = 0.010448 seconds
*** |--> disk read = 0.006778 seconds
*** |--> calc = 0.005967 seconds
*** Disk write bandwidth = 19.3203024988335 MB/s
*** Disk read bandwidth = 29.6215913963374 MB/s
*** Minimum energy = -106.191465740481
*** Maximum discarded weight = 0
******************************************************************
Stats: nIt(DAVIDSON) = 1
Energy at sites (0, 1) is -106.191465740481
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -106.191465740481
Stats: nIt(DAVIDSON) = 1
Energy at sites (2, 3) is -106.191465740481
Stats: nIt(DAVIDSON) = 1
Energy at sites (3, 4) is -106.191465740481
Stats: nIt(DAVIDSON) = 2
Energy at sites (4, 5) is -106.191465741735
Stats: nIt(DAVIDSON) = 8
Energy at sites (5, 6) is -106.191466519622
Stats: nIt(DAVIDSON) = 1
Energy at sites (6, 7) is -106.191466519622
Stats: nIt(DAVIDSON) = 1
Energy at sites (7, 8) is -106.191466519622
******************************************************************
*** Information on right sweep 1 of instruction 0:
*** Elapsed wall time = 0.054948 seconds
*** |--> S.join = 0.001977 seconds
*** |--> S.solve = 0.009184 seconds
*** |--> S.split = 0.001474 seconds
*** |--> Tensor update = 0.04203 seconds
*** |--> create = 0.020068 seconds
*** |--> destroy = 0.00117 seconds
*** |--> disk write = 0.010381 seconds
*** |--> disk read = 0.006381 seconds
*** |--> calc = 0.003999 seconds
*** Disk write bandwidth = 19.3406364015389 MB/s
*** Disk read bandwidth = 31.6343081817603 MB/s
*** Minimum energy = -106.191466519622
*** Maximum discarded weight = 0
*** Energy difference with respect to previous leftright sweep = 3.52978386501945e-05
******************************************************************
*** 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 = -106.191466519622
*** Minimum energy encountered during the last sweep = -106.191466519622
*** Maximum discarded weight during the last sweep = 0
******************************************************************
Stats: nIt(DAVIDSON) = 9
Energy at sites (8, 9) is -106.191466519637
Stats: nIt(DAVIDSON) = 10
Energy at sites (7, 8) is -106.191466519653
Stats: nIt(DAVIDSON) = 10
Energy at sites (6, 7) is -106.191466519654
Stats: nIt(DAVIDSON) = 13
Energy at sites (5, 6) is -106.19146651966
Stats: nIt(DAVIDSON) = 17
Energy at sites (4, 5) is -106.191466569098
Stats: nIt(DAVIDSON) = 17
Energy at sites (3, 4) is -106.191466571934
Stats: nIt(DAVIDSON) = 7
Energy at sites (2, 3) is -106.191466571934
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -106.191466571934
******************************************************************
*** Information on left sweep 0 of instruction 1:
*** Elapsed wall time = 0.084319 seconds
*** |--> S.join = 0.00258 seconds
*** |--> S.solve = 0.03948 seconds
*** |--> S.split = 0.001571 seconds
*** |--> Tensor update = 0.040394 seconds
*** |--> create = 0.020089 seconds
*** |--> destroy = 0.001209 seconds
*** |--> disk write = 0.010273 seconds
*** |--> disk read = 0.006355 seconds
*** |--> calc = 0.002444 seconds
*** Disk write bandwidth = 19.6494228081196 MB/s
*** Disk read bandwidth = 31.5932567245279 MB/s
*** Minimum energy = -106.191466571934
*** Maximum discarded weight = 0
******************************************************************
Stats: nIt(DAVIDSON) = 1
Energy at sites (0, 1) is -106.191466571934
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -106.191466571934
Stats: nIt(DAVIDSON) = 1
Energy at sites (2, 3) is -106.191466571934
Stats: nIt(DAVIDSON) = 4
Energy at sites (3, 4) is -106.191466571934
Stats: nIt(DAVIDSON) = 12
Energy at sites (4, 5) is -106.191466571936
Stats: nIt(DAVIDSON) = 18
Energy at sites (5, 6) is -106.191466575658
Stats: nIt(DAVIDSON) = 3
Energy at sites (6, 7) is -106.191466575658
Stats: nIt(DAVIDSON) = 1
Energy at sites (7, 8) is -106.191466575658
******************************************************************
*** Information on right sweep 0 of instruction 1:
*** Elapsed wall time = 0.070069 seconds
*** |--> S.join = 0.002006 seconds
*** |--> S.solve = 0.025429 seconds
*** |--> S.split = 0.001503 seconds
*** |--> Tensor update = 0.040547 seconds
*** |--> create = 0.020114 seconds
*** |--> destroy = 0.001193 seconds
*** |--> disk write = 0.010426 seconds
*** |--> disk read = 0.006403 seconds
*** |--> calc = 0.00238 seconds
*** Disk write bandwidth = 19.2571596474559 MB/s
*** Disk read bandwidth = 31.5256161967535 MB/s
*** Minimum energy = -106.191466575658
*** Maximum discarded weight = 0
*** Energy difference with respect to previous leftright sweep = 5.60363559998223e-08
******************************************************************
Stats: nIt(DAVIDSON) = 1
Energy at sites (8, 9) is -106.191466575658
Stats: nIt(DAVIDSON) = 1
Energy at sites (7, 8) is -106.191466575658
Stats: nIt(DAVIDSON) = 1
Energy at sites (6, 7) is -106.191466575658
Stats: nIt(DAVIDSON) = 2
Energy at sites (5, 6) is -106.191466575659
Stats: nIt(DAVIDSON) = 15
Energy at sites (4, 5) is -106.191466575917
Stats: nIt(DAVIDSON) = 14
Energy at sites (3, 4) is -106.191466575929
Stats: nIt(DAVIDSON) = 4
Energy at sites (2, 3) is -106.191466575929
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -106.191466575929
******************************************************************
*** Information on left sweep 1 of instruction 1:
*** Elapsed wall time = 0.06251 seconds
*** |--> S.join = 0.002353 seconds
*** |--> S.solve = 0.018611 seconds
*** |--> S.split = 0.001611 seconds
*** |--> Tensor update = 0.0398 seconds
*** |--> create = 0.020073 seconds
*** |--> destroy = 0.001303 seconds
*** |--> disk write = 0.010033 seconds
*** |--> disk read = 0.006258 seconds
*** |--> calc = 0.002109 seconds
*** Disk write bandwidth = 20.1194578399095 MB/s
*** Disk read bandwidth = 32.0829572522172 MB/s
*** Minimum energy = -106.191466575929
*** Maximum discarded weight = 0
******************************************************************
Stats: nIt(DAVIDSON) = 1
Energy at sites (0, 1) is -106.191466575929
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -106.191466575929
Stats: nIt(DAVIDSON) = 1
Energy at sites (2, 3) is -106.191466575929
Stats: nIt(DAVIDSON) = 2
Energy at sites (3, 4) is -106.191466575929
Stats: nIt(DAVIDSON) = 8
Energy at sites (4, 5) is -106.191466575929
Stats: nIt(DAVIDSON) = 15
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 = 0.062079 seconds
*** |--> S.join = 0.00228 seconds
*** |--> S.solve = 0.017999 seconds
*** |--> S.split = 0.001758 seconds
*** |--> Tensor update = 0.039904 seconds
*** |--> create = 0.020123 seconds
*** |--> destroy = 0.001173 seconds
*** |--> disk write = 0.009836 seconds
*** |--> disk read = 0.00635 seconds
*** |--> calc = 0.002394 seconds
*** Disk write bandwidth = 20.412275974418 MB/s
*** Disk read bandwidth = 31.7887433870571 MB/s
*** Minimum energy = -106.191466575949
*** Maximum discarded weight = 0
*** Energy difference with respect to previous leftright sweep = 2.90157231574995e-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 -106.191466575949
Stats: nIt(DAVIDSON) = 13
Energy at sites (4, 5) is -106.19146657595
Stats: nIt(DAVIDSON) = 11
Energy at sites (3, 4) is -106.19146657595
Stats: nIt(DAVIDSON) = 3
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 = 0.058273 seconds
*** |--> S.join = 0.002347 seconds
*** |--> S.solve = 0.014582 seconds
*** |--> S.split = 0.001547 seconds
*** |--> Tensor update = 0.039658 seconds
*** |--> create = 0.020079 seconds
*** |--> destroy = 0.001208 seconds
*** |--> disk write = 0.009866 seconds
*** |--> disk read = 0.006234 seconds
*** |--> calc = 0.002243 seconds
*** Disk write bandwidth = 20.4600162687829 MB/s
*** Disk read bandwidth = 32.2064720058349 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) = 5
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 = 0.057563 seconds
*** |--> S.join = 0.003023 seconds
*** |--> S.solve = 0.013032 seconds
*** |--> S.split = 0.001521 seconds
*** |--> Tensor update = 0.039853 seconds
*** |--> create = 0.020149 seconds
*** |--> destroy = 0.001176 seconds
*** |--> disk write = 0.009803 seconds
*** |--> disk read = 0.006375 seconds
*** |--> calc = 0.00232 seconds
*** Disk write bandwidth = 20.4809901544808 MB/s
*** Disk read bandwidth = 31.6640816482843 MB/s
*** Minimum energy = -106.19146657595
*** Maximum discarded weight = 0
*** Energy difference with respect to previous leftright sweep = 1.53477230924182e-12
******************************************************************
*** 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 = [ 1.99999399659708 , 1.99366325652285 , 1.87190049171889 ].
NOON of irrep B2g = [ 0.584814303146688 ].
NOON of irrep B3g = [ 0.584814261575739 ].
NOON of irrep B1u = [ 1.99999783389178 , 1.12096429158813 , 1.00219410745139 ].
NOON of irrep B2u = [ 1.42082875191469 ].
NOON of irrep B3u = [ 1.42082870559275 ].
Single-orbital entropies (Hamiltonian index order is used!) = [ 8.17128195492867e-05 , 0.0722109533518336 , 0.460791908908941 , 1.13075780180199 , 1.13075778764072 , 6.17502955295581e-05 , 0.977139014545608 , 0.73593648148745 , 1.12042722125771 , 1.12042724439422 ].
Idistance(0) = 5.65234392827253
Idistance(1) = 19.838295786757
Idistance(2) = 88.8195416356793
***************************************************
*** Timing information 2-RDM and Correlations ***
***************************************************
*** Elapsed wall time = 0.106728 seconds
*** |--> MPS gauge change = 0.003353 seconds
*** |--> Diagram calc = 0.006024 seconds
*** |--> Tensor update = 0.096101 seconds
*** |--> create = 0.046936 seconds
*** |--> destroy = 0.002863 seconds
*** |--> disk write = 0.02414 seconds
*** |--> disk read = 0.015161 seconds
*** |--> calc = 0.006871 seconds
*** Disk write bandwidth = 17.4954595305056 MB/s
*** Disk read bandwidth = 27.8570274432034 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 = 0.009333 seconds
FCI::matvec : Wall time = 0.00943 seconds
FCI::matvec : Wall time = 0.010911 seconds
FCI::matvec : Wall time = 0.010826 seconds
FCI::matvec : Wall time = 0.010397 seconds
FCI::matvec : Wall time = 0.008976 seconds
FCI::matvec : Wall time = 0.008616 seconds
FCI::matvec : Wall time = 0.00842 seconds
FCI::matvec : Wall time = 0.009375 seconds
FCI::matvec : Wall time = 0.011846 seconds
FCI::matvec : Wall time = 0.008802 seconds
FCI::matvec : Wall time = 0.008554 seconds
FCI::matvec : Wall time = 0.008244 seconds
FCI::matvec : Wall time = 0.007931 seconds
FCI::matvec : Wall time = 0.008028 seconds
FCI::matvec : Wall time = 0.008877 seconds
FCI::matvec : Wall time = 0.008677 seconds
FCI::matvec : Wall time = 0.009265 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) = 16
Energy at sites (8, 9) is -101.078981020806
Stats: nIt(DAVIDSON) = 28
Energy at sites (7, 8) is -106.575384978684
Stats: nIt(DAVIDSON) = 32
Energy at sites (6, 7) is -106.778702402817
Stats: nIt(DAVIDSON) = 70
Energy at sites (5, 6) is -107.041047634767
Stats: nIt(DAVIDSON) = 31
Energy at sites (4, 5) is -107.345563132654
Stats: nIt(DAVIDSON) = 18
Energy at sites (3, 4) is -107.34565848178
Stats: nIt(DAVIDSON) = 7
Energy at sites (2, 3) is -107.345660215884
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -107.345660215884
******************************************************************
*** Information on left sweep 0 of instruction 0:
*** Elapsed wall time = 1.169886 seconds
*** |--> S.join = 0.012301 seconds
*** |--> S.solve = 1.010073 seconds
*** |--> S.split = 0.03796 seconds
*** |--> Tensor update = 0.108718 seconds
*** |--> create = 0.025646 seconds
*** |--> destroy = 0.001412 seconds
*** |--> disk write = 0.012753 seconds
*** |--> disk read = 0.007934 seconds
*** |--> calc = 0.060932 seconds
*** Disk write bandwidth = 64.2034518226104 MB/s
*** Disk read bandwidth = 102.742961771037 MB/s
*** Minimum energy = -107.345660215884
*** Maximum discarded weight = 0
******************************************************************
Stats: nIt(DAVIDSON) = 1
Energy at sites (0, 1) is -107.345660215884
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -107.345660215884
Stats: nIt(DAVIDSON) = 1
Energy at sites (2, 3) is -107.345660215884
Stats: nIt(DAVIDSON) = 4
Energy at sites (3, 4) is -107.345660218637
Stats: nIt(DAVIDSON) = 4
Energy at sites (4, 5) is -107.345660269902
Stats: nIt(DAVIDSON) = 14
Energy at sites (5, 6) is -107.346319615859
Stats: nIt(DAVIDSON) = 5
Energy at sites (6, 7) is -107.346324662795
Stats: nIt(DAVIDSON) = 1
Energy at sites (7, 8) is -107.346324662795
******************************************************************
*** Information on right sweep 0 of instruction 0:
*** Elapsed wall time = 0.088208 seconds
*** |--> S.join = 0.003909 seconds
*** |--> S.solve = 0.033157 seconds
*** |--> S.split = 0.002438 seconds
*** |--> Tensor update = 0.048083 seconds
*** |--> create = 0.02477 seconds
*** |--> destroy = 0.001263 seconds
*** |--> disk write = 0.010904 seconds
*** |--> disk read = 0.006594 seconds
*** |--> calc = 0.004523 seconds
*** Disk write bandwidth = 74.7581308411048 MB/s
*** Disk read bandwidth = 124.171462100963 MB/s
*** Minimum energy = -107.346324662795
*** Maximum discarded weight = 0
*** Energy difference with respect to previous leftright sweep = 107.346324662795
******************************************************************
Stats: nIt(DAVIDSON) = 1
Energy at sites (8, 9) is -107.346324662795
Stats: nIt(DAVIDSON) = 1
Energy at sites (7, 8) is -107.346324662795
Stats: nIt(DAVIDSON) = 1
Energy at sites (6, 7) is -107.346324662795
Stats: nIt(DAVIDSON) = 6
Energy at sites (5, 6) is -107.346324667822
Stats: nIt(DAVIDSON) = 6
Energy at sites (4, 5) is -107.346326066964
Stats: nIt(DAVIDSON) = 5
Energy at sites (3, 4) is -107.346326105149
Stats: nIt(DAVIDSON) = 2
Energy at sites (2, 3) is -107.346326105161
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -107.346326105161
******************************************************************
*** Information on left sweep 1 of instruction 0:
*** Elapsed wall time = 0.075858 seconds
*** |--> S.join = 0.004459 seconds
*** |--> S.solve = 0.020615 seconds
*** |--> S.split = 0.002449 seconds
*** |--> Tensor update = 0.047615 seconds
*** |--> create = 0.024325 seconds
*** |--> destroy = 0.001392 seconds
*** |--> disk write = 0.010987 seconds
*** |--> disk read = 0.006364 seconds
*** |--> calc = 0.004516 seconds
*** Disk write bandwidth = 74.5232202688404 MB/s
*** Disk read bandwidth = 128.089669813232 MB/s
*** Minimum energy = -107.346326105161
*** Maximum discarded weight = 0
******************************************************************
Stats: nIt(DAVIDSON) = 1
Energy at sites (0, 1) is -107.346326105161
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -107.346326105161
Stats: nIt(DAVIDSON) = 1
Energy at sites (2, 3) is -107.346326105161
Stats: nIt(DAVIDSON) = 1
Energy at sites (3, 4) is -107.346326105161
Stats: nIt(DAVIDSON) = 2
Energy at sites (4, 5) is -107.346326105203
Stats: nIt(DAVIDSON) = 4
Energy at sites (5, 6) is -107.346326114643
Stats: nIt(DAVIDSON) = 2
Energy at sites (6, 7) is -107.346326114914
Stats: nIt(DAVIDSON) = 1
Energy at sites (7, 8) is -107.346326114914
******************************************************************
*** Information on right sweep 1 of instruction 0:
*** Elapsed wall time = 0.066118 seconds
*** |--> S.join = 0.002077 seconds
*** |--> S.solve = 0.012659 seconds
*** |--> S.split = 0.002567 seconds
*** |--> Tensor update = 0.048672 seconds
*** |--> create = 0.024862 seconds
*** |--> destroy = 0.001289 seconds
*** |--> disk write = 0.011156 seconds
*** |--> disk read = 0.006424 seconds
*** |--> calc = 0.004915 seconds
*** Disk write bandwidth = 73.0694387496779 MB/s
*** Disk read bandwidth = 127.457444130409 MB/s
*** Minimum energy = -107.346326114914
*** Maximum discarded weight = 0
*** Energy difference with respect to previous leftright sweep = 1.45211913604726e-06
******************************************************************
*** 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 = -107.346326114914
*** Minimum energy encountered during the last sweep = -107.346326114914
*** Maximum discarded weight during the last sweep = 0
******************************************************************
Stats: nIt(DAVIDSON) = 7
Energy at sites (8, 9) is -107.346326114917
Stats: nIt(DAVIDSON) = 9
Energy at sites (7, 8) is -107.34632611492
Stats: nIt(DAVIDSON) = 12
Energy at sites (6, 7) is -107.346326114922
Stats: nIt(DAVIDSON) = 18
Energy at sites (5, 6) is -107.346326114924
Stats: nIt(DAVIDSON) = 11
Energy at sites (4, 5) is -107.346326115022
Stats: nIt(DAVIDSON) = 13
Energy at sites (3, 4) is -107.346326115023
Stats: nIt(DAVIDSON) = 7
Energy at sites (2, 3) is -107.346326115023
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -107.346326115023
******************************************************************
*** Information on left sweep 0 of instruction 1:
*** Elapsed wall time = 0.130454 seconds
*** |--> S.join = 0.00198 seconds
*** |--> S.solve = 0.077793 seconds
*** |--> S.split = 0.002635 seconds
*** |--> Tensor update = 0.047906 seconds
*** |--> create = 0.02458 seconds
*** |--> destroy = 0.001294 seconds
*** |--> disk write = 0.010849 seconds
*** |--> disk read = 0.006317 seconds
*** |--> calc = 0.004831 seconds
*** Disk write bandwidth = 75.4711605764356 MB/s
*** Disk read bandwidth = 129.042687777649 MB/s
*** Minimum energy = -107.346326115023
*** Maximum discarded weight = 0
******************************************************************
Stats: nIt(DAVIDSON) = 1
Energy at sites (0, 1) is -107.346326115023
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -107.346326115023
Stats: nIt(DAVIDSON) = 1
Energy at sites (2, 3) is -107.346326115023
Stats: nIt(DAVIDSON) = 5
Energy at sites (3, 4) is -107.346326115023
Stats: nIt(DAVIDSON) = 7
Energy at sites (4, 5) is -107.346326115023
Stats: nIt(DAVIDSON) = 13
Energy at sites (5, 6) is -107.346326115024
Stats: nIt(DAVIDSON) = 8
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 = 0.091523 seconds
*** |--> S.join = 0.001913 seconds
*** |--> S.solve = 0.03853 seconds
*** |--> S.split = 0.002469 seconds
*** |--> Tensor update = 0.048247 seconds
*** |--> create = 0.024864 seconds
*** |--> destroy = 0.001272 seconds
*** |--> disk write = 0.010955 seconds
*** |--> disk read = 0.00645 seconds
*** |--> calc = 0.004676 seconds
*** Disk write bandwidth = 74.4101012041448 MB/s
*** Disk read bandwidth = 126.943662185078 MB/s
*** Minimum energy = -107.346326115024
*** Maximum discarded weight = 0
*** Energy difference with respect to previous leftright sweep = 1.09963593786233e-10
******************************************************************
Stats: nIt(DAVIDSON) = 1
Energy at sites (8, 9) is -107.346326115024
Stats: nIt(DAVIDSON) = 1
Energy at sites (7, 8) is -107.346326115024
Stats: nIt(DAVIDSON) = 1
Energy at sites (6, 7) is -107.346326115024
Stats: nIt(DAVIDSON) = 7
Energy at sites (5, 6) is -107.346326115024
Stats: nIt(DAVIDSON) = 8
Energy at sites (4, 5) is -107.346326115024
Stats: nIt(DAVIDSON) = 7
Energy at sites (3, 4) is -107.346326115024
Stats: nIt(DAVIDSON) = 3
Energy at sites (2, 3) is -107.346326115025
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -107.346326115025
******************************************************************
*** Information on left sweep 1 of instruction 1:
*** Elapsed wall time = 0.160101 seconds
*** |--> S.join = 0.006223 seconds
*** |--> S.solve = 0.082995 seconds
*** |--> S.split = 0.010923 seconds
*** |--> Tensor update = 0.05939 seconds
*** |--> create = 0.0245 seconds
*** |--> destroy = 0.001261 seconds
*** |--> disk write = 0.011769 seconds
*** |--> disk read = 0.006474 seconds
*** |--> calc = 0.015349 seconds
*** Disk write bandwidth = 69.5714692067083 MB/s
*** Disk read bandwidth = 125.91329297056 MB/s
*** Minimum energy = -107.346326115025
*** Maximum discarded weight = 0
******************************************************************
Stats: nIt(DAVIDSON) = 1
Energy at sites (0, 1) is -107.346326115025
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -107.346326115025
Stats: nIt(DAVIDSON) = 1
Energy at sites (2, 3) is -107.346326115025
Stats: nIt(DAVIDSON) = 2
Energy at sites (3, 4) is -107.346326115024
Stats: nIt(DAVIDSON) = 2
Energy at sites (4, 5) is -107.346326115025
Stats: nIt(DAVIDSON) = 8
Energy at sites (5, 6) is -107.346326115025
Stats: nIt(DAVIDSON) = 3
Energy at sites (6, 7) is -107.346326115025
Stats: nIt(DAVIDSON) = 1
Energy at sites (7, 8) is -107.346326115025
******************************************************************
*** Information on right sweep 1 of instruction 1:
*** Elapsed wall time = 0.074682 seconds
*** |--> S.join = 0.0022 seconds
*** |--> S.solve = 0.020549 seconds
*** |--> S.split = 0.00252400000000004 seconds
*** |--> Tensor update = 0.049062 seconds
*** |--> create = 0.024716 seconds
*** |--> destroy = 0.001298 seconds
*** |--> disk write = 0.011432 seconds
*** |--> disk read = 0.006707 seconds
*** |--> calc = 0.004877 seconds
*** Disk write bandwidth = 71.3053410331881 MB/s
*** Disk read bandwidth = 122.079412717124 MB/s
*** Minimum energy = -107.346326115025
*** Maximum discarded weight = 0
*** Energy difference with respect to previous leftright sweep = 2.55795384873636e-13
******************************************************************
*** 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) = -107.346326115025
NOON of irrep Ag = [ 1.99999018535377 , 1.99292175281355 , 1.03221285672776 ].
NOON of irrep B2g = [ 1.02415310259757 ].
NOON of irrep B3g = [ 0.0896934287757976 ].
NOON of irrep B1u = [ 1.99999295584655 , 1.95039154290325 , 0.0159495095317837 ].
NOON of irrep B2u = [ 1.91962159297097 ].
NOON of irrep B3u = [ 1.97507307247901 ].
Single-orbital entropies (Hamiltonian index order is used!) = [ 0.000121322990874813 , 0.0447141464686297 , 0.83896699455486 , 0.790658960251757 , 0.317368561184153 , 9.24989500735943e-05 , 0.227634117094491 , 0.0907424585079664 , 0.299652804881886 , 0.133979297019841 ].
Idistance(0) = 1.57215407913464
Idistance(1) = 5.15805448325434
Idistance(2) = 21.9866409865531
***************************************************
*** Timing information 2-RDM and Correlations ***
***************************************************
*** Elapsed wall time = 0.127881 seconds
*** |--> MPS gauge change = 0.003047 seconds
*** |--> Diagram calc = 0.007874 seconds
*** |--> Tensor update = 0.115136 seconds
*** |--> create = 0.057334 seconds
*** |--> destroy = 0.003019 seconds
*** |--> disk write = 0.025309 seconds
*** |--> disk read = 0.015649 seconds
*** |--> calc = 0.013691 seconds
*** Disk write bandwidth = 65.6235245838005 MB/s
*** Disk read bandwidth = 106.132390803975 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 = 0.019268 seconds
FCI::matvec : Wall time = 0.016035 seconds
FCI::matvec : Wall time = 0.016899 seconds
FCI::matvec : Wall time = 0.01629 seconds
FCI::matvec : Wall time = 0.011906 seconds
FCI::matvec : Wall time = 0.015121 seconds
FCI::matvec : Wall time = 0.012915 seconds
FCI::matvec : Wall time = 0.012471 seconds
FCI::matvec : Wall time = 0.013294 seconds
FCI::matvec : Wall time = 0.012049 seconds
FCI::matvec : Wall time = 0.011099 seconds
FCI::matvec : Wall time = 0.01279 seconds
FCI::matvec : Wall time = 0.01125 seconds
FCI::matvec : Wall time = 0.013515 seconds
FCI::matvec : Wall time = 0.013843 seconds
FCI::matvec : Wall time = 0.01443 seconds
FCI::matvec : Wall time = 0.013004 seconds
FCI::matvec : Wall time = 0.01254 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) = 16
Energy at sites (8, 9) is -101.550376577289
Stats: nIt(DAVIDSON) = 27
Energy at sites (7, 8) is -106.56498113219
Stats: nIt(DAVIDSON) = 49
Energy at sites (6, 7) is -106.950059386627
Stats: nIt(DAVIDSON) = 60
Energy at sites (5, 6) is -107.182010831844
Stats: nIt(DAVIDSON) = 43
Energy at sites (4, 5) is -107.18837324184
Stats: nIt(DAVIDSON) = 39
Energy at sites (3, 4) is -107.199504476312
Stats: nIt(DAVIDSON) = 12
Energy at sites (2, 3) is -107.199524158456
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -107.199524158456
******************************************************************
*** Information on left sweep 0 of instruction 0:
*** Elapsed wall time = 1.11697 seconds
*** |--> S.join = 0.00669 seconds
*** |--> S.solve = 1.010356 seconds
*** |--> S.split = 0.020707 seconds
*** |--> Tensor update = 0.078477 seconds
*** |--> create = 0.024641 seconds
*** |--> destroy = 0.00129 seconds
*** |--> disk write = 0.012058 seconds
*** |--> disk read = 0.007161 seconds
*** |--> calc = 0.033298 seconds
*** Disk write bandwidth = 69.7610627005282 MB/s
*** Disk read bandwidth = 116.960610479071 MB/s
*** Minimum energy = -107.199524158456
*** Maximum discarded weight = 0
******************************************************************
Stats: nIt(DAVIDSON) = 1
Energy at sites (0, 1) is -107.199524158456
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -107.199524158456
Stats: nIt(DAVIDSON) = 1
Energy at sites (2, 3) is -107.199524158456
Stats: nIt(DAVIDSON) = 5
Energy at sites (3, 4) is -107.199524161973
Stats: nIt(DAVIDSON) = 8
Energy at sites (4, 5) is -107.199536612821
Stats: nIt(DAVIDSON) = 21
Energy at sites (5, 6) is -107.199614635893
Stats: nIt(DAVIDSON) = 9
Energy at sites (6, 7) is -107.199617255522
Stats: nIt(DAVIDSON) = 1
Energy at sites (7, 8) is -107.199617255522
******************************************************************
*** Information on right sweep 0 of instruction 0:
*** Elapsed wall time = 0.108994 seconds
*** |--> S.join = 0.002129 seconds
*** |--> S.solve = 0.055088 seconds
*** |--> S.split = 0.002563 seconds
*** |--> Tensor update = 0.048852 seconds
*** |--> create = 0.024461 seconds
*** |--> destroy = 0.001224 seconds
*** |--> disk write = 0.011423 seconds
*** |--> disk read = 0.00657 seconds
*** |--> calc = 0.005146 seconds
*** Disk write bandwidth = 73.3218008964917 MB/s
*** Disk read bandwidth = 128.033317205931 MB/s
*** Minimum energy = -107.199617255522
*** Maximum discarded weight = 0
*** Energy difference with respect to previous leftright sweep = 107.199617255522
******************************************************************
Stats: nIt(DAVIDSON) = 1
Energy at sites (8, 9) is -107.199617255522
Stats: nIt(DAVIDSON) = 1
Energy at sites (7, 8) is -107.199617255522
Stats: nIt(DAVIDSON) = 1
Energy at sites (6, 7) is -107.199617255522
Stats: nIt(DAVIDSON) = 12
Energy at sites (5, 6) is -107.199617259787
Stats: nIt(DAVIDSON) = 6
Energy at sites (4, 5) is -107.199617362125
Stats: nIt(DAVIDSON) = 6
Energy at sites (3, 4) is -107.199617419959
Stats: nIt(DAVIDSON) = 3
Energy at sites (2, 3) is -107.199617421372
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -107.199617421372
******************************************************************
*** Information on left sweep 1 of instruction 0:
*** Elapsed wall time = 0.087562 seconds
*** |--> S.join = 0.002131 seconds
*** |--> S.solve = 0.032435 seconds
*** |--> S.split = 0.00281 seconds
*** |--> Tensor update = 0.050043 seconds
*** |--> create = 0.02429 seconds
*** |--> destroy = 0.001275 seconds
*** |--> disk write = 0.011134 seconds
*** |--> disk read = 0.006321 seconds
*** |--> calc = 0.006997 seconds
*** Disk write bandwidth = 75.5504665028713 MB/s
*** Disk read bandwidth = 132.503548748715 MB/s
*** Minimum energy = -107.199617421372
*** Maximum discarded weight = 0
******************************************************************
Stats: nIt(DAVIDSON) = 1
Energy at sites (0, 1) is -107.199617421372
Stats: nIt(DAVIDSON) = 1
Energy at sites (1, 2) is -107.199617421372
Stats: nIt(DAVIDSON) = 1
Energy at sites (2, 3) is -107.199617421372
Stats: nIt(DAVIDSON) = 1
Energy at sites (3, 4) is -107.199617421372
Stats: nIt(DAVIDSON) = 2
Energy at sites (4, 5) is -107.199617421463
Stats: nIt(DAVIDSON) = 2
Energy at sites (5, 6) is -107.199617421867
Stats: nIt(DAVIDSON) = 2
Energy at sites (6, 7) is -107.199617421898
Stats: nIt(DAVIDSON) = 1
Energy at sites (7, 8) is -107.199617421898
******************************************************************
*** Information on right sweep 1 of instruction 0:
*** Elapsed wall time = 0.061709 seconds
*** |--> S.join = 0.001962 seconds
*** |--> S.solve = 0.009329 seconds
*** |--> S.split = 0.002479 seconds
*** |--> Tensor update = 0.047798 seconds
*** |--> create = 0.024669 seconds
*** |--> destroy = 0.001271 seconds
*** |--> disk write = 0.01087 seconds
*** |--> disk read = 0.006392 seconds
*** |--> calc = 0.004563 seconds
*** Disk write bandwidth = 77.0519716320722 MB/s
*** Disk read bandwidth = 131.598700569926 MB/s
*** Minimum energy = -107.199617421898
*** Maximum discarded weight = 0
*** Energy difference with respect to previous leftright sweep = 1.66376139532076e-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 = -107.199617421898
*** Minimum energy encountered during the last sweep = -107.199617421898
*** Maximum discarded weight during the last sweep = 0
******************************************************************
Stats: nIt(DAVIDSON) = 8
Energy at sites (8, 9) is -107.199617421901
Stats: nIt(DAVIDSON) = 10
Energy at sites (7, 8) is -107.199617421902
Stats: nIt(DAVIDSON) = 16
Energy at sites (6, 7) is -107.199617421907
Stats: nIt(DAVIDSON) = 24
Energy at sites (5, 6) is -107.199617421916
Stats: nIt(DAVIDSON) = 12
Energy at sites (4, 5) is -107.199617421918
Stats: nIt(DAVIDSON) = 13
Energy at sites (3, 4) is -107.199617421919
Stats: nIt(DAVIDSON) = 8
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 = 0.139482 seconds
*** |--> S.join = 0.001861 seconds
*** |--> S.solve = 0.0871420000000001 seconds
*** |--> S.split = 0.002498 seconds
*** |--> Tensor update = 0.047522 seconds
*** |--> create = 0.024338 seconds
*** |--> destroy = 0.001268 seconds
*** |--> disk write = 0.011031 seconds
*** |--> disk read = 0.006311 seconds
*** |--> calc = 0.004544 seconds
*** Disk write bandwidth = 76.255905542831 MB/s
*** Disk read bandwidth = 132.713505251248 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) = 5
Energy at sites (3, 4) is -107.199617421919
Stats: nIt(DAVIDSON) = 7
Energy at sites (4, 5) is -107.199617421919
Stats: nIt(DAVIDSON) = 18
Energy at sites (5, 6) is -107.199617421919
Stats: nIt(DAVIDSON) = 10
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 = 0.101112 seconds
*** |--> S.join = 0.001924 seconds
*** |--> S.solve = 0.047471 seconds
*** |--> S.split = 0.002603 seconds
*** |--> Tensor update = 0.048746 seconds
*** |--> create = 0.024719 seconds
*** |--> destroy = 0.001259 seconds
*** |--> disk write = 0.011181 seconds
*** |--> disk read = 0.00648 seconds
*** |--> calc = 0.005081 seconds
*** Disk write bandwidth = 74.9087676988306 MB/s
*** Disk read bandwidth = 129.81155772268 MB/s
*** Minimum energy = -107.199617421919
*** Maximum discarded weight = 0
*** Energy difference with respect to previous leftright sweep = 2.09467998502078e-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 = [ 1.99998814651105 , 1.9892404156568 , 1.87687858004394 ].
NOON of irrep B2g = [ 0.139387811452889 ].
NOON of irrep B3g = [ 1.03112739684311 ].
NOON of irrep B1u = [ 1.9999943124415 , 1.10839164059514 , 0.0211636956588088 ].
NOON of irrep B2u = [ 1.96715797368671 ].
NOON of irrep B3u = [ 1.86667002711005 ].
Single-orbital entropies (Hamiltonian index order is used!) = [ 0.000149980004020684 , 0.0818410215260917 , 0.449623197927548 , 0.486645056028554 , 0.811029481761552 , 6.68868116309372e-05 , 0.962046613515957 , 0.112095070258907 , 0.167176149901152 , 0.475082461536613 ].
Idistance(0) = 2.38445939381305
Idistance(1) = 9.57998274539516
Idistance(2) = 47.8783647120688
***************************************************
*** Timing information 2-RDM and Correlations ***
***************************************************
*** Elapsed wall time = 0.128357 seconds
*** |--> MPS gauge change = 0.004762 seconds
*** |--> Diagram calc = 0.008112 seconds
*** |--> Tensor update = 0.114035 seconds
*** |--> create = 0.056269 seconds
*** |--> destroy = 0.002986 seconds
*** |--> disk write = 0.025331 seconds
*** |--> disk read = 0.015679 seconds
*** |--> calc = 0.013647 seconds
*** Disk write bandwidth = 67.334504346052 MB/s
*** Disk read bandwidth = 108.785657860185 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 = 0.013114 seconds
FCI::matvec : Wall time = 0.013483 seconds
FCI::matvec : Wall time = 0.012251 seconds
FCI::matvec : Wall time = 0.015111 seconds
FCI::matvec : Wall time = 0.013695 seconds
FCI::matvec : Wall time = 0.015524 seconds
FCI::matvec : Wall time = 0.011979 seconds
FCI::matvec : Wall time = 0.011926 seconds
FCI::matvec : Wall time = 0.011096 seconds
FCI::matvec : Wall time = 0.012583 seconds
FCI::matvec : Wall time = 0.012178 seconds
FCI::matvec : Wall time = 0.012401 seconds
FCI::matvec : Wall time = 0.012176 seconds
FCI::matvec : Wall time = 0.013247 seconds
FCI::matvec : Wall time = 0.013576 seconds
FCI::matvec : Wall time = 0.013046 seconds
FCI::matvec : Wall time = 0.013501 seconds
FCI::matvec : Wall time = 0.014019 seconds
FCI::matvec : Wall time = 0.013914 seconds
FCI::matvec : Wall time = 0.011984 seconds
FCI::matvec : Wall time = 0.015164 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/reproducible-path/chemps2-1.8.12'
create-stamp debian/debhelper-build-stamp
dh_prep
debian/rules override_dh_auto_install
make[1]: Entering directory '/build/reproducible-path/chemps2-1.8.12'
dh_auto_install
cd obj-i686-linux-gnu && make -j22 install DESTDIR=/build/reproducible-path/chemps2-1.8.12/debian/tmp AM_UPDATE_INFO_DIR=no "INSTALL=install --strip-program=true"
make[2]: Entering directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-linux-gnu'
Install the project...
-- Install configuration: "release"
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/share/cmake/CheMPS2/CheMPS2Config.cmake
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/share/cmake/CheMPS2/CheMPS2ConfigVersion.cmake
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/share/cmake/CheMPS2/FindTargetHDF5.cmake
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/lib/i386-linux-gnu/libchemps2.so.3
-- Set non-toolchain portion of runtime path of "/build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/lib/i386-linux-gnu/libchemps2.so.3" to ""
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/lib/i386-linux-gnu/libchemps2.so
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/bin/chemps2
-- Set non-toolchain portion of runtime path of "/build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/bin/chemps2" to ""
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/lib/i386-linux-gnu/libchemps2.a
-- Up-to-date: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/bin/chemps2
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/Tensor3RDM.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/ConjugateGradient.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/TensorT.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/TensorL.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/FourIndex.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/DMRGSCFmatrix.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/DMRGSCFwtilde.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/Options.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/Heff.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/FCI.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/Problem.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/Lapack.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/Wigner.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/TensorX.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/TensorS0.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/Cumulant.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/Tensor.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/DMRGSCFintegrals.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/TensorGYZ.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/Excitation.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/ConvergenceScheme.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/ThreeDM.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/TensorS1.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/DMRGSCFrotations.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/TensorOperator.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/Irreps.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/DMRG.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/TensorKM.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/Sobject.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/Molden.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/TensorO.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/TwoDM.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/TensorQ.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/CASPT2.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/SyBookkeeper.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/TensorF1.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/DMRGSCFunitary.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/DMRGSCFoptions.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/Special.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/TwoIndex.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/MPIchemps2.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/DIIS.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/Correlations.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/CASSCF.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/EdmistonRuedenberg.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/Davidson.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/TensorF0.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/DMRGSCFindices.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/Hamiltonian.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/include/chemps2/Initialize.h
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/share/cmake/CheMPS2/CheMPS2Targets-shared.cmake
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/share/cmake/CheMPS2/CheMPS2Targets-shared-release.cmake
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/share/cmake/CheMPS2/CheMPS2Targets-static.cmake
-- Installing: /build/reproducible-path/chemps2-1.8.12/debian/tmp/usr/share/cmake/CheMPS2/CheMPS2Targets-static-release.cmake
make[2]: Leaving directory '/build/reproducible-path/chemps2-1.8.12/obj-i686-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
/usr/lib/python3/dist-packages/setuptools/_distutils/cmd.py:79: SetuptoolsDeprecationWarning: setup.py install is deprecated.
!!
********************************************************************************
Please avoid running ``setup.py`` directly.
Instead, use pypa/build, pypa/installer or other
standards-based tools.
See https://blog.ganssle.io/articles/2021/10/setup-py-deprecated.html for details.
********************************************************************************
!!
self.initialize_options()
dh_numpy3
Possible precedence issue with control flow operator (return) at /usr/bin/dh_numpy3 line 57.
Can't stat debian/libchemps2-3t64: No such file or directory
at /usr/bin/dh_numpy3 line 85.
dh_numpy3: warning: skipping binary package libchemps2-3t64 which does not depend on the NumPy C ABI
Can't stat debian/libchemps2-dev: No such file or directory
at /usr/bin/dh_numpy3 line 85.
dh_numpy3: warning: skipping binary package libchemps2-dev which does not depend on the NumPy C ABI
Can't stat debian/chemps2: No such file or directory
at /usr/bin/dh_numpy3 line 85.
dh_numpy3: warning: skipping binary package chemps2 which does not depend on the NumPy C ABI
Can't stat debian/python3-chemps2: No such file or directory
at /usr/bin/dh_numpy3 line 85.
dh_numpy3: warning: skipping binary package python3-chemps2 which does not depend on the NumPy C ABI
make[1]: Leaving directory '/build/reproducible-path/chemps2-1.8.12'
dh_install
dh_installdocs
debian/rules override_dh_installchangelogs
make[1]: Entering directory '/build/reproducible-path/chemps2-1.8.12'
dh_installchangelogs -k CHANGELOG.md
make[1]: Leaving directory '/build/reproducible-path/chemps2-1.8.12'
dh_installman
dh_python3
dh_lintian
dh_perl
dh_link
dh_strip_nondeterminism
dh_compress
dh_fixperms
dh_missing
dh_dwz -a
dh_strip -a
dh_makeshlibs -a
dpkg-gensymbols: warning: debian/libchemps2-3t64/DEBIAN/symbols doesn't match completely debian/libchemps2-3t64.symbols
--- debian/libchemps2-3t64.symbols (libchemps2-3t64_1.8.12-4_i386)
+++ dpkg-gensymbolss0sXJe 2026-04-24 01:43:19.101314357 -1200
@@ -142,12 +142,12 @@
_ZN7CheMPS216DMRGSCFintegralsD0Ev@Base 1.8.7
_ZN7CheMPS216DMRGSCFintegralsD1Ev@Base 1.8.7
_ZN7CheMPS216DMRGSCFintegralsD2Ev@Base 1.8.7
-#MISSING: 1.8.10-2# (optional)_ZN7CheMPS216DMRGSCFrotations10close_fileEiii@Base 1.8.7
- (optional)_ZN7CheMPS216DMRGSCFrotations10close_fileElll@Base 1.8.7
-#MISSING: 1.8.10-2# (optional)_ZN7CheMPS216DMRGSCFrotations10close_fileExxx@Base 1.8.7
-#MISSING: 1.8.10-2# (optional)_ZN7CheMPS216DMRGSCFrotations10write_fileEiiPdiii@Base 1.8.7
- (optional)_ZN7CheMPS216DMRGSCFrotations10write_fileEllPdiii@Base 1.8.7
-#MISSING: 1.8.10-2# (optional)_ZN7CheMPS216DMRGSCFrotations10write_fileExxPdiii@Base 1.8.7
+#MISSING: 1.8.12-4# (optional)_ZN7CheMPS216DMRGSCFrotations10close_fileEiii@Base 1.8.7
+#MISSING: 1.8.12-4# (optional)_ZN7CheMPS216DMRGSCFrotations10close_fileElll@Base 1.8.7
+ (optional)_ZN7CheMPS216DMRGSCFrotations10close_fileExxx@Base 1.8.7
+#MISSING: 1.8.12-4# (optional)_ZN7CheMPS216DMRGSCFrotations10write_fileEiiPdiii@Base 1.8.7
+#MISSING: 1.8.12-4# (optional)_ZN7CheMPS216DMRGSCFrotations10write_fileEllPdiii@Base 1.8.7
+ (optional)_ZN7CheMPS216DMRGSCFrotations10write_fileExxPdiii@Base 1.8.7
_ZN7CheMPS216DMRGSCFrotations13package_firstEPdS1_iii@Base 1.8.7
_ZN7CheMPS216DMRGSCFrotations15blockwise_firstEPdS1_iiiS1_ii@Base 1.8.7
_ZN7CheMPS216DMRGSCFrotations15blockwise_thirdEPdS1_iiiS1_ii@Base 1.8.7
@@ -159,11 +159,11 @@
_ZN7CheMPS216DMRGSCFrotations5writeEPdPNS_9FourIndexEPNS_16DMRGSCFintegralsEcccciiiiPNS_14DMRGSCFindicesEiib@Base 1.8.7
_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
-#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
-#MISSING: 1.8.10-2# (optional)_ZN7CheMPS216DMRGSCFrotations9read_fileExxPdiii@Base 1.8.7
+#MISSING: 1.8.12-4# (optional)_ZN7CheMPS216DMRGSCFrotations9open_fileEPiS1_S1_iiNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEE@Base 1.8.7
+ (optional)_ZN7CheMPS216DMRGSCFrotations9open_fileEPxS1_S1_iiNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEE@Base 1.8.7
+#MISSING: 1.8.12-4# (optional)_ZN7CheMPS216DMRGSCFrotations9read_fileEiiPdiii@Base 1.8.7
+#MISSING: 1.8.12-4# (optional)_ZN7CheMPS216DMRGSCFrotations9read_fileEllPdiii@Base 1.8.7
+ (optional)_ZN7CheMPS216DMRGSCFrotations9read_fileExxPdiii@Base 1.8.7
_ZN7CheMPS217ConjugateGradient12apply_preconEPd@Base 1.8.7
_ZN7CheMPS217ConjugateGradient12apply_preconEPdS1_@Base 1.8.7
_ZN7CheMPS217ConjugateGradient4stepEPPd@Base 1.8.7
@@ -242,12 +242,12 @@
_ZN7CheMPS24DMRG16symm_4rdm_helperEPdiiddbd@Base 1.8.7
_ZN7CheMPS24DMRG16updateMovingLeftEi@Base 1.8.7
_ZN7CheMPS24DMRG17updateMovingRightEi@Base 1.8.7
-#MISSING: 1.8.10-2# (optional)_ZN7CheMPS24DMRG18MY_HDF5_READ_BATCHEiiPPNS_6TensorExNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEE@Base 1.8.7
- (optional)_ZN7CheMPS24DMRG18MY_HDF5_READ_BATCHEliPPNS_6TensorExNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEE@Base 1.8.7
-#MISSING: 1.8.10-2# (optional)_ZN7CheMPS24DMRG18MY_HDF5_READ_BATCHExiPPNS_6TensorExNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEE@Base 1.8.7
-#MISSING: 1.8.10-2# (optional)_ZN7CheMPS24DMRG19MY_HDF5_WRITE_BATCHEiiPPNS_6TensorExNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEE@Base 1.8.7
- (optional)_ZN7CheMPS24DMRG19MY_HDF5_WRITE_BATCHEliPPNS_6TensorExNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEE@Base 1.8.7
-#MISSING: 1.8.10-2# (optional)_ZN7CheMPS24DMRG19MY_HDF5_WRITE_BATCHExiPPNS_6TensorExNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEE@Base 1.8.7
+#MISSING: 1.8.12-4# (optional)_ZN7CheMPS24DMRG18MY_HDF5_READ_BATCHEiiPPNS_6TensorExNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEE@Base 1.8.7
+#MISSING: 1.8.12-4# (optional)_ZN7CheMPS24DMRG18MY_HDF5_READ_BATCHEliPPNS_6TensorExNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEE@Base 1.8.7
+ (optional)_ZN7CheMPS24DMRG18MY_HDF5_READ_BATCHExiPPNS_6TensorExNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEE@Base 1.8.7
+#MISSING: 1.8.12-4# (optional)_ZN7CheMPS24DMRG19MY_HDF5_WRITE_BATCHEiiPPNS_6TensorExNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEE@Base 1.8.7
+#MISSING: 1.8.12-4# (optional)_ZN7CheMPS24DMRG19MY_HDF5_WRITE_BATCHEliPPNS_6TensorExNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEE@Base 1.8.7
+ (optional)_ZN7CheMPS24DMRG19MY_HDF5_WRITE_BATCHExiPPNS_6TensorExNSt7__cxx1112basic_stringIcSt11char_traitsIcESaIcEEE@Base 1.8.7
_ZN7CheMPS24DMRG19activateExcitationsEi@Base 1.8.7
_ZN7CheMPS24DMRG19prepare_excitationsEPNS_7SobjectE@Base 1.8.7
_ZN7CheMPS24DMRG20updateMovingLeftSafeEi@Base 1.8.7
dh_shlibdeps -a
dh_installdeb
dh_gencontrol
dpkg-gencontrol: warning: Depends field of package libchemps2-dev: substitution variable ${shlibs:Depends} used, but is not defined
dpkg-gencontrol: warning: Depends field of package chemps2-doc: substitution variable ${sphinxdoc:Depends} used, but is not defined
dh_md5sums
dh_builddeb
dpkg-deb: building package 'libchemps2-3t64-dbgsym' in '../libchemps2-3t64-dbgsym_1.8.12-4_i386.deb'.
dpkg-deb: building package 'libchemps2-3t64' in '../libchemps2-3t64_1.8.12-4_i386.deb'.
dpkg-deb: building package 'libchemps2-dev' in '../libchemps2-dev_1.8.12-4_i386.deb'.
dpkg-deb: building package 'chemps2-doc' in '../chemps2-doc_1.8.12-4_all.deb'.
dpkg-deb: building package 'chemps2' in '../chemps2_1.8.12-4_i386.deb'.
dpkg-deb: building package 'chemps2-dbgsym' in '../chemps2-dbgsym_1.8.12-4_i386.deb'.
dpkg-deb: building package 'python3-chemps2' in '../python3-chemps2_1.8.12-4_i386.deb'.
dpkg-deb: building package 'python3-chemps2-dbgsym' in '../python3-chemps2-dbgsym_1.8.12-4_i386.deb'.
dpkg-genbuildinfo --build=binary -O../chemps2_1.8.12-4_i386.buildinfo
dpkg-genchanges --build=binary -O../chemps2_1.8.12-4_i386.changes
dpkg-genchanges: info: binary-only upload (no source code included)
dpkg-source --after-build .
dpkg-buildpackage: info: binary-only upload (no source included)
dpkg-genchanges: info: not including original source code in upload
I: copying local configuration
I: unmounting dev/ptmx filesystem
I: unmounting dev/pts filesystem
I: unmounting dev/shm filesystem
I: unmounting proc filesystem
I: unmounting sys filesystem
I: cleaning the build env
I: removing directory /srv/workspace/pbuilder/123616 and its subdirectories
I: Current time: Fri Apr 24 01:43:23 -12 2026
I: pbuilder-time-stamp: 1777038203
Sat Mar 22 07:20:24 UTC 2025 I: 1st build successful. Starting 2nd build on remote node ionos2-i386.debian.net.
Sat Mar 22 07:20:24 UTC 2025 I: Preparing to do remote build '2' on ionos2-i386.debian.net.
Sat Mar 22 07:23:35 UTC 2025 I: Deleting $TMPDIR on ionos2-i386.debian.net.
Sat Mar 22 07:23:35 UTC 2025 I: chemps2_1.8.12-4_i386.changes:
Format: 1.8
Date: Sun, 16 Mar 2025 14:28:37 +0100
Source: chemps2
Binary: chemps2 chemps2-dbgsym chemps2-doc libchemps2-3t64 libchemps2-3t64-dbgsym libchemps2-dev python3-chemps2 python3-chemps2-dbgsym
Architecture: i386 all
Version: 1.8.12-4
Distribution: unstable
Urgency: medium
Maintainer: Debichem Team <debichem-devel@lists.alioth.debian.org>
Changed-By: Michael Banck <mbanck@debian.org>
Description:
chemps2 - Executable to call libchemps2-3t64 from the command line
chemps2-doc - Documentation of the libchemps2-3t64 package
libchemps2-3t64 - Spin-adapted DMRG for ab initio quantum chemistry
libchemps2-dev - C++ headers, static library, and symlink for libchemps2-3t64
python3-chemps2 - Python 3 interface for libchemps2-3t64
Closes: 1092786
Changes:
chemps2 (1.8.12-4) unstable; urgency=medium
.
* Acknowledge NMU.
* debian/control (Build-Depends): Switch back from cython3-legacy to cython3
(Closes: #1092786).
Checksums-Sha1:
e45ad786e6fdf2936cf5a28d128a47bfbea2c9f1 133940 chemps2-dbgsym_1.8.12-4_i386.deb
8f73da9e4f6db5833b6032a7424f628a504aedf2 507188 chemps2-doc_1.8.12-4_all.deb
3f76ca80a5a6f0beec37eb38f5c9be72b01aa51d 11185 chemps2_1.8.12-4_i386.buildinfo
6ba136f210967fe7767f5ccdeb4996db811bad9f 29892 chemps2_1.8.12-4_i386.deb
6c440fdd4f472cced0aeddebbd3d2a43e3e3b53f 1617128 libchemps2-3t64-dbgsym_1.8.12-4_i386.deb
0127510002ddf85162091911bbda7d08be883991 505860 libchemps2-3t64_1.8.12-4_i386.deb
15d49496e3e46c9137425e2042ba19d6017927bc 65924 libchemps2-dev_1.8.12-4_i386.deb
6fc33ada8c87f4f9894ba7392befb534615f32df 573884 python3-chemps2-dbgsym_1.8.12-4_i386.deb
40a8a2ea62e8ab198cc70d74921b5ff0f2b61473 105468 python3-chemps2_1.8.12-4_i386.deb
Checksums-Sha256:
f793b36d1f2b02bc50cd840715db8e0dfd7a8cbf27495f5ff98008b874c9d819 133940 chemps2-dbgsym_1.8.12-4_i386.deb
511b8a53a2c9c20514d948aede35d6422a3d6858f0361fc80dfcfd3ca2b435f2 507188 chemps2-doc_1.8.12-4_all.deb
7052e94c0bff5660d8ceb2bca72f257c4e83a102ea10172e26b7ba41d30503de 11185 chemps2_1.8.12-4_i386.buildinfo
67828d0d8947c787a7e6fa1a0527e0c63ee066cecdf609cb1a078da99db96774 29892 chemps2_1.8.12-4_i386.deb
cb8c95395b36e9d0aaef6475b1be078c2bfa16026821b9bf04559c261611711a 1617128 libchemps2-3t64-dbgsym_1.8.12-4_i386.deb
263b2ab4aa98d5bbec6bed1f4112c56ed24246b4392b6f442234287e1547df03 505860 libchemps2-3t64_1.8.12-4_i386.deb
793f05b70d6c850ad462b60ef50167233e4200c89ee605e295b6a338717ae140 65924 libchemps2-dev_1.8.12-4_i386.deb
b2f437df69f65e6041979b6a3dbeb0c3332b78f2317f6614df58a11be5c63443 573884 python3-chemps2-dbgsym_1.8.12-4_i386.deb
0f6f6dd421952063d550bf2cdab2b904694c609ce19d3d92a48b458986c6c00b 105468 python3-chemps2_1.8.12-4_i386.deb
Files:
4f07ab40648252c6c0771516f311d448 133940 debug optional chemps2-dbgsym_1.8.12-4_i386.deb
0fabe78ab60b29860185c5958d33b6ec 507188 doc optional chemps2-doc_1.8.12-4_all.deb
19636ad15f39ba3730a3517cecffc433 11185 libs optional chemps2_1.8.12-4_i386.buildinfo
2e23538f49e09a0337fe2d0f2077b947 29892 science optional chemps2_1.8.12-4_i386.deb
818571d3236754e54928650b74e5bb2c 1617128 debug optional libchemps2-3t64-dbgsym_1.8.12-4_i386.deb
c907d089181c7d8ce068f06f42a577f9 505860 libs optional libchemps2-3t64_1.8.12-4_i386.deb
f57e72249007599d360140d086b69fe7 65924 libdevel optional libchemps2-dev_1.8.12-4_i386.deb
4cd588ae2d3fd8b031ccae7f10d4296a 573884 debug optional python3-chemps2-dbgsym_1.8.12-4_i386.deb
ba27100ed8f25d28f38acfe1fe7c48ad 105468 python optional python3-chemps2_1.8.12-4_i386.deb
Sat Mar 22 07:23:37 UTC 2025 I: diffoscope 291 will be used to compare the two builds:
Running as unit: rb-diffoscope-i386_2-61219.service
# Profiling output for: /usr/bin/diffoscope --timeout 7200 --html /srv/reproducible-results/rbuild-debian/r-b-build.DWpQvwU9/chemps2_1.8.12-4.diffoscope.html --text /srv/reproducible-results/rbuild-debian/r-b-build.DWpQvwU9/chemps2_1.8.12-4.diffoscope.txt --json /srv/reproducible-results/rbuild-debian/r-b-build.DWpQvwU9/chemps2_1.8.12-4.diffoscope.json --profile=- /srv/reproducible-results/rbuild-debian/r-b-build.DWpQvwU9/b1/chemps2_1.8.12-4_i386.changes /srv/reproducible-results/rbuild-debian/r-b-build.DWpQvwU9/b2/chemps2_1.8.12-4_i386.changes
## command (total time: 0.000s)
0.000s 1 call cmp (internal)
## has_same_content_as (total time: 0.000s)
0.000s 1 call diffoscope.comparators.binary.FilesystemFile
## main (total time: 0.004s)
0.004s 2 calls outputs
0.000s 1 call cleanup
Finished with result: success
Main processes terminated with: code=exited/status=0
Service runtime: 231ms
CPU time consumed: 232ms
Sat Mar 22 07:23:37 UTC 2025 I: diffoscope 291 found no differences in the changes files, and a .buildinfo file also exists.
Sat Mar 22 07:23:37 UTC 2025 I: chemps2 from trixie built successfully and reproducibly on i386.
Sat Mar 22 07:23:38 UTC 2025 I: Submitting .buildinfo files to external archives:
Sat Mar 22 07:23:38 UTC 2025 I: Submitting 12K b1/chemps2_1.8.12-4_i386.buildinfo.asc
Sat Mar 22 07:23:39 UTC 2025 I: Submitting 12K b2/chemps2_1.8.12-4_i386.buildinfo.asc
Sat Mar 22 07:23:41 UTC 2025 I: Done submitting .buildinfo files to http://buildinfo.debian.net/api/submit.
Sat Mar 22 07:23:41 UTC 2025 I: Done submitting .buildinfo files.
Sat Mar 22 07:23:41 UTC 2025 I: Removing signed chemps2_1.8.12-4_i386.buildinfo.asc files:
removed './b1/chemps2_1.8.12-4_i386.buildinfo.asc'
removed './b2/chemps2_1.8.12-4_i386.buildinfo.asc'