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| Name: cp2k-mpich | Distribution: Fedora Project |
| Version: 2024.3 | Vendor: Fedora Project |
| Release: 4.fc43 | Build date: Thu Feb 6 21:44:07 2025 |
| Group: Unspecified | Build host: buildhw-x86-03.iad2.fedoraproject.org |
| Size: 61961143 | Source RPM: cp2k-2024.3-4.fc43.src.rpm |
| Packager: Fedora Project | |
| Url: https://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.
GPL-2.0-or-later
* Thu Feb 06 2025 Cristian Le <git@lecris.dev> - 2024.3-4 - Rebuild with dbcsr 2.8.0 * Thu Jan 16 2025 Fedora Release Engineering <releng@fedoraproject.org> - 2024.3-3 - Rebuilt for https://fedoraproject.org/wiki/Fedora_42_Mass_Rebuild * Mon Oct 28 2024 Cristian Le <cristian.le@mpsd.mpg.de> - 2024.3-2 - Rebuild for dbcsr 2.7.0 * Thu Oct 24 2024 Packit <hello@packit.dev> - 2024.3-1 - Update to 2024.3 upstream release * Thu Oct 24 2024 Zbigniew Jędrzejewski-Szmek <zbyszek@in.waw.pl> - 2024.1-13 - Apply patches to make build reproducible * Thu Oct 24 2024 Zbigniew Jędrzejewski-Szmek <zbyszek@in.waw.pl> - 2024.1-12 - Drop unneeded call to modules.sh * Sat Oct 12 2024 Susi Lehtola <jussilehtola@fedoraproject.org> - 2024.1-11 - [skip changelog] add patch to fix broken detection logic * Sat Oct 12 2024 Susi Lehtola <jussilehtola@fedoraproject.org> - 2024.1-10 - [skip changelog] fix comment format * Sat Oct 12 2024 Susi Lehtola <jussilehtola@fedoraproject.org> - Rebuild against libxc 7.0.0 in rawhide * Sun Jul 21 2024 Antonio Trande <sagitter@fedoraproject.org> - 2024.1-8 - Rebuild again for spglib-2.5.0 * Sun Jul 21 2024 Antonio Trande <sagitter@fedoraproject.org> - 2024.1-7 - Rebuild for spglib-2.5.0 * Wed Jul 17 2024 Fedora Release Engineering <releng@fedoraproject.org> - 2024.1-6 - Rebuilt for https://fedoraproject.org/wiki/Fedora_41_Mass_Rebuild * Tue Apr 23 2024 Cristian Le <cristian.le@mpsd.mpg.de> - 2024.1-5 - Add packit workflow from upstream - Droped elpa, metis, etc. requirements - Follow upstream's Default dependencies - Split test execution between spec and testing-farm * 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
/usr/lib/.build-id /usr/lib/.build-id/14 /usr/lib/.build-id/14/b7d75564e219f58e6795a276a90b88bab05624 /usr/lib/.build-id/55 /usr/lib/.build-id/55/fea144c4976c3ada2a5730c28f97e12df0113d /usr/lib/.build-id/7e /usr/lib/.build-id/7e/fb4ec782c5fa4b80d30045d3f41f5f6ad6875b /usr/lib/.build-id/82 /usr/lib/.build-id/82/8fd0f53d83e9a224a465b9bbd3eba5cf94aca1 /usr/lib/.build-id/93 /usr/lib/.build-id/93/11297976b9037f231f2673055f1cbcdf483e5e /usr/lib/.build-id/c7 /usr/lib/.build-id/c7/3b13e7659d53a37c24cadbf5d7ff7cd458d6f9 /usr/lib/.build-id/d7 /usr/lib/.build-id/d7/064ea6fcc2461fc7254f92e367f8526f245b82 /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.2024.3
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Fabrice Bellet, Thu Feb 13 00:34:13 2025