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Name: cp2k-mpich | Distribution: Fedora Project |
Version: 2024.1 | Vendor: Fedora Project |
Release: 4.fc40 | Build date: Fri Jan 26 23:01:25 2024 |
Group: Unspecified | Build host: buildvm-s390x-13.s390.fedoraproject.org |
Size: 58754504 | Source RPM: cp2k-2024.1-4.fc40.src.rpm |
Packager: Fedora Project | |
Url: httsp://www.cp2k.org/ | |
Summary: Molecular simulations software - mpich version |
CP2K is a freely available (GPL) program, written in Fortran 95, to perform atomistic and molecular simulations of solid state, liquid, molecular and biological systems. It provides a general framework for different methods such as e.g. density functional theory (DFT) using a mixed Gaussian and plane waves approach (GPW), and classical pair and many-body potentials. CP2K does not implement Car-Parinello Molecular Dynamics (CPMD). This package contains the parallel single- and multi-threaded versions using mpich.
GPLv2+
* Fri Jan 26 2024 Cristian Le <cristian.le@mpsd.mpg.de> - 2024.1-4 - Updated Spglib library dependency * Wed Jan 24 2024 Fedora Release Engineering <releng@fedoraproject.org> - 2024.1-3 - Rebuilt for https://fedoraproject.org/wiki/Fedora_40_Mass_Rebuild * Sun Jan 14 2024 Orion Poplawski <orion@nwra.com> - 2024.1-1 - Update to 2024.1 * Wed Jul 19 2023 Fedora Release Engineering <releng@fedoraproject.org> - 2023.1-3 - Rebuilt for https://fedoraproject.org/wiki/Fedora_39_Mass_Rebuild * Thu Jan 19 2023 Fedora Release Engineering <releng@fedoraproject.org> - 2023.1-2 - Rebuilt for https://fedoraproject.org/wiki/Fedora_38_Mass_Rebuild * Tue Jan 03 2023 Dominik Mierzejewski <dominik@greysector.net> - 2023.1-1 - update to 2023.1 (#2105463) * Thu Oct 27 2022 Mamoru TASAKA <mtasaka@fedoraproject.org> - 9.1-4 - Rebuild for new libxc * Wed Jul 20 2022 Fedora Release Engineering <releng@fedoraproject.org> - 9.1-3 - Rebuilt for https://fedoraproject.org/wiki/Fedora_37_Mass_Rebuild * Tue Mar 22 2022 Dominik Mierzejewski <dominik@greysector.net> - 9.1-2 - fix three failing tests due to wrong LD_LIBRARY_PATH setting * Wed Mar 16 2022 Dominik Mierzejewski <dominik@greysector.net> - 9.1-1 - update to 9.1 (#2036421) - re-enable LTO on x86_64
/usr/lib/.build-id /usr/lib/.build-id/3f /usr/lib/.build-id/3f/234bf57248bdbb8296c43cb005d25726e5461d /usr/lib/.build-id/59 /usr/lib/.build-id/59/6083896d909044f2fca0eefe80b03ef7da6979 /usr/lib/.build-id/73/0f755150f17360002dcf38d1b9f55d96b2b714 /usr/lib/.build-id/77 /usr/lib/.build-id/77/6bf85da1fea649249224e021fbc0e3ffe8f7ad /usr/lib/.build-id/9a /usr/lib/.build-id/9a/fd75b0845e0bf134a46a286106239bff156b8a /usr/lib/.build-id/9b /usr/lib/.build-id/9b/f2cc5b23d2a404f30a5c7dc1d4472334c37699 /usr/lib/.build-id/af/533bb543b60cc1ba2730733bf4460ea3909cde /usr/lib64/mpich/bin/cp2k.psmp /usr/lib64/mpich/bin/dbm_miniapp.psmp /usr/lib64/mpich/bin/dumpdcd.psmp /usr/lib64/mpich/bin/graph.psmp /usr/lib64/mpich/bin/grid_miniapp.psmp /usr/lib64/mpich/bin/xyz2dcd.psmp /usr/lib64/mpich/lib/libcp2k.so.23.1 /usr/lib64/mpich/lib/libcp2k.so.23.1.00
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Fabrice Bellet, Wed Apr 9 20:02:46 2025