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Name: cp2k-mpich | Distribution: Fedora Project |
Version: 2024.3 | Vendor: Fedora Project |
Release: 2.fc41 | Build date: Mon Oct 28 14:13:50 2024 |
Group: Unspecified | Build host: buildvm-a64-09.iad2.fedoraproject.org |
Size: 50784069 | Source RPM: cp2k-2024.3-2.fc41.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
* 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/lib/.build-id /usr/lib/.build-id/0b /usr/lib/.build-id/0b/3b2b5a975d9e1d899f989090baf9350f880161 /usr/lib/.build-id/1c /usr/lib/.build-id/1c/2dc25f3f0f320eb1519b4fdf4c5bc12c5a665a /usr/lib/.build-id/1c/e63fab6f87661c2c2c6ec0dadc0b63fb2abe33 /usr/lib/.build-id/5a /usr/lib/.build-id/5a/45c5ee65e741c925fc2bf8aae82215d9af080a /usr/lib/.build-id/5f /usr/lib/.build-id/5f/5e44e649caf8e1b01b2d269a96396c7470e3fe /usr/lib/.build-id/71 /usr/lib/.build-id/71/c924724c2c527c926ce04d27056505cac38b5e /usr/lib/.build-id/eb /usr/lib/.build-id/eb/7f8c345201c0677b7ded16f3d7d15266b9c41a /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.2024.3
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Fabrice Bellet, Tue Dec 3 03:57:20 2024