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Name: cp2k-openmpi | Distribution: Fedora Project |
Version: 2024.1 | Vendor: Fedora Project |
Release: 8.fc41 | Build date: Sun Jul 21 20:33:42 2024 |
Group: Unspecified | Build host: buildhw-x86-11.iad2.fedoraproject.org |
Size: 60541238 | Source RPM: cp2k-2024.1-8.fc41.src.rpm |
Packager: Fedora Project | |
Url: https://www.cp2k.org/ | |
Summary: Molecular simulations software - openmpi 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 OpenMPI.
GPL-2.0-or-later
* 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) * Thu Oct 27 2022 Mamoru TASAKA <mtasaka@fedoraproject.org> - 9.1-4 - Rebuild for new libxc
/usr/lib/.build-id /usr/lib/.build-id/3f /usr/lib/.build-id/3f/9cf2d25de7c08b67c4512aa7bd6dc191cc1b51 /usr/lib/.build-id/88 /usr/lib/.build-id/88/d6fe58d0c62e03210f034a9ecbcef608c51895 /usr/lib/.build-id/95 /usr/lib/.build-id/95/0ad192b6d50cd0e068979907273aa01d61e6be /usr/lib/.build-id/ad /usr/lib/.build-id/ad/78f305a3b33d32b85ba65a3281b5bcf58a00ee /usr/lib/.build-id/c8 /usr/lib/.build-id/c8/2013a3da4aa09d139f3ce0f975b79089850ce1 /usr/lib/.build-id/dc /usr/lib/.build-id/dc/f5ce5c2088b022c485aa4a054e01877de7ec31 /usr/lib/.build-id/f9 /usr/lib/.build-id/f9/d24f29e36f9dd9a21b7b7653fa3e77617b8cee /usr/lib64/openmpi/bin/cp2k.psmp /usr/lib64/openmpi/bin/dbm_miniapp.psmp /usr/lib64/openmpi/bin/dumpdcd.psmp /usr/lib64/openmpi/bin/graph.psmp /usr/lib64/openmpi/bin/grid_miniapp.psmp /usr/lib64/openmpi/bin/xyz2dcd.psmp /usr/lib64/openmpi/lib/libcp2k.so.23.1 /usr/lib64/openmpi/lib/libcp2k.so.23.1.00
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Fabrice Bellet, Wed Sep 11 01:06:19 2024