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Name: cp2k-mpich | Distribution: Fedora Project |
Version: 2024.1 | Vendor: Fedora Project |
Release: 4.fc40 | Build date: Fri Jan 26 23:02:14 2024 |
Group: Unspecified | Build host: buildvm-x86-06.iad2.fedoraproject.org |
Size: 61682326 | 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/61 /usr/lib/.build-id/61/2456adae587cde2c6373abd034749cd8be335a /usr/lib/.build-id/62 /usr/lib/.build-id/62/f862587093e67c518966312f46e51251c7e8a1 /usr/lib/.build-id/72/4f8d96fede8a815b92ac5c088f44fb37bcbae3 /usr/lib/.build-id/99 /usr/lib/.build-id/99/d31dd2fd38ccda867de86616887457dce41c9b /usr/lib/.build-id/c1 /usr/lib/.build-id/c1/7728c11732dabf6243c680535c077bb313eeb5 /usr/lib/.build-id/c8 /usr/lib/.build-id/c8/c0c038c0e50486f1243cf32354ff690d59b7e9 /usr/lib/.build-id/fc /usr/lib/.build-id/fc/4de18ed1e4839515fb9d5b7e3b519f983e38a1 /usr/lib/mpich/bin/cp2k.psmp /usr/lib/mpich/bin/dbm_miniapp.psmp /usr/lib/mpich/bin/dumpdcd.psmp /usr/lib/mpich/bin/graph.psmp /usr/lib/mpich/bin/grid_miniapp.psmp /usr/lib/mpich/bin/xyz2dcd.psmp /usr/lib/mpich/lib/libcp2k.so.23.1 /usr/lib/mpich/lib/libcp2k.so.23.1.00
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Fabrice Bellet, Sun Mar 9 17:59:04 2025