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Name: cp2k-mpich | Distribution: Fedora Project |
Version: 2024.1 | Vendor: Fedora Project |
Release: 11.fc41 | Build date: Wed Oct 16 07:05:07 2024 |
Group: Unspecified | Build host: buildvm-a64-08.iad2.fedoraproject.org |
Size: 49534104 | Source RPM: cp2k-2024.1-11.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
* 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) * Thu Oct 27 2022 Mamoru TASAKA <mtasaka@fedoraproject.org> - 9.1-4 - Rebuild for new libxc
/usr/lib/.build-id /usr/lib/.build-id/03 /usr/lib/.build-id/03/72c1ac013c42197913e5bac717bd74f6430c5a /usr/lib/.build-id/0c /usr/lib/.build-id/0c/6db4fa016054956c658594bac0707e1029a586 /usr/lib/.build-id/39 /usr/lib/.build-id/39/822c204c2fffbf60dc50680d9a22c81a039ebe /usr/lib/.build-id/3e /usr/lib/.build-id/3e/c7920a21c54e7c5e4406d40a8a71b61834bc3b /usr/lib/.build-id/ba/60d6c5db36a752dcbba85499dac71c77aa0bfc /usr/lib/.build-id/d4 /usr/lib/.build-id/d4/3fb18a9417892ca34d85b662c3bbc2aca0965e /usr/lib/.build-id/f5 /usr/lib/.build-id/f5/4096d0f3f1ad3abb341270dc43631a453c0fc4 /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.23.1 /usr/lib64/mpich/lib/libcp2k.so.23.1.00
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Fabrice Bellet, Sun Oct 27 05:22:42 2024