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| Name: cp2k | Distribution: Fedora Project |
| Version: 2024.3 | Vendor: Fedora Project |
| Release: 2.fc42 | Build date: Mon Oct 28 14:02:55 2024 |
| Group: Unspecified | Build host: buildhw-a64-06.iad2.fedoraproject.org |
| Size: 50894915 | Source RPM: cp2k-2024.3-2.fc42.src.rpm |
| Packager: Fedora Project | |
| Url: https://www.cp2k.org/ | |
| Summary: Ab Initio Molecular Dynamics | |
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 non-MPI single process and multi-threaded versions.
GPL-2.0-or-later
* Mon Oct 28 2024 Cristian Le <[email protected]> - 2024.3-2 - Rebuild for dbcsr 2.7.0 * Thu Oct 24 2024 Packit <[email protected]> - 2024.3-1 - Update to 2024.3 upstream release * Thu Oct 24 2024 Zbigniew Jędrzejewski-Szmek <[email protected]> - 2024.1-13 - Apply patches to make build reproducible * Thu Oct 24 2024 Zbigniew Jędrzejewski-Szmek <[email protected]> - 2024.1-12 - Drop unneeded call to modules.sh * Sat Oct 12 2024 Susi Lehtola <[email protected]> - 2024.1-11 - [skip changelog] add patch to fix broken detection logic * Sat Oct 12 2024 Susi Lehtola <[email protected]> - 2024.1-10 - [skip changelog] fix comment format * Sat Oct 12 2024 Susi Lehtola <[email protected]> - Rebuild against libxc 7.0.0 in rawhide * Sun Jul 21 2024 Antonio Trande <[email protected]> - 2024.1-8 - Rebuild again for spglib-2.5.0 * Sun Jul 21 2024 Antonio Trande <[email protected]> - 2024.1-7 - Rebuild for spglib-2.5.0 * Wed Jul 17 2024 Fedora Release Engineering <[email protected]> - 2024.1-6 - Rebuilt for https://fedoraproject.org/wiki/Fedora_41_Mass_Rebuild * Tue Apr 23 2024 Cristian Le <[email protected]> - 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 <[email protected]> - 2024.1-4 - Updated Spglib library dependency * Wed Jan 24 2024 Fedora Release Engineering <[email protected]> - 2024.1-3 - Rebuilt for https://fedoraproject.org/wiki/Fedora_40_Mass_Rebuild * Sun Jan 14 2024 Orion Poplawski <[email protected]> - 2024.1-1 - Update to 2024.1 * Wed Jul 19 2023 Fedora Release Engineering <[email protected]> - 2023.1-3 - Rebuilt for https://fedoraproject.org/wiki/Fedora_39_Mass_Rebuild * Thu Jan 19 2023 Fedora Release Engineering <[email protected]> - 2023.1-2 - Rebuilt for https://fedoraproject.org/wiki/Fedora_38_Mass_Rebuild * Tue Jan 03 2023 Dominik Mierzejewski <[email protected]> - 2023.1-1 - update to 2023.1 (#2105463)
/usr/bin/cp2k.ssmp /usr/bin/dbm_miniapp.ssmp /usr/bin/dumpdcd.ssmp /usr/bin/graph.ssmp /usr/bin/grid_miniapp.ssmp /usr/bin/xyz2dcd.ssmp /usr/lib/.build-id /usr/lib/.build-id/51 /usr/lib/.build-id/51/25dc798a19b230f0bbba42b868beb5c44a1ee6 /usr/lib/.build-id/bd /usr/lib/.build-id/bd/752326d57fd4a715b46967e314042ebc632f04 /usr/lib/.build-id/c1 /usr/lib/.build-id/c1/8d8a20b6cfd698d7006987bea95c28298a5083 /usr/lib/.build-id/c6 /usr/lib/.build-id/c6/b4311d6b3f492e1a3db8e3e5494c3f0dc25c74 /usr/lib/.build-id/e6 /usr/lib/.build-id/e6/f86a3a2b4724aaf3f00841b0735f5dac6ec08f /usr/lib/.build-id/ea /usr/lib/.build-id/ea/c07959683c1bb0465aafb1f31f20fc03480b6b /usr/lib/.build-id/ec /usr/lib/.build-id/ec/8c56becf4d901ccf50b6055adf07ff3e1db896 /usr/lib64/libcp2k.so.2024.3
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Fabrice Bellet, Tue Dec 3 01:12:47 2024