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| Name: cp2k | 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: 50456355 | Source RPM: cp2k-2024.3-2.fc41.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 <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 * 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)
/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/4d /usr/lib/.build-id/4d/2d9b7e71625c8c69eeb2c5e0786cdb083ebafa /usr/lib/.build-id/8b /usr/lib/.build-id/8b/87c360493e2eff067031d9eb5f16ea1be7eb0a /usr/lib/.build-id/a0 /usr/lib/.build-id/a0/d17e80c088d481c515691b606e6ea637a78a17 /usr/lib/.build-id/c6 /usr/lib/.build-id/c6/2d7a4114e2a8f3d029303ef87f5c4555214bde /usr/lib/.build-id/ec /usr/lib/.build-id/ec/d319e68c819590058bdffc8b1ef39d81b24cee /usr/lib/.build-id/f9 /usr/lib/.build-id/f9/6670bd734540094979df6b07903ca8d109b430 /usr/lib/.build-id/fc /usr/lib/.build-id/fc/c8c7a9fd7d9139bb1f7b8c32d7f233fbe33fba /usr/lib64/libcp2k.so.2024.3
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