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| Name: cp2k-openmpi | Distribution: Fedora Project |
| Version: 2026.2 | Vendor: Fedora Project |
| Release: 3.fc45 | Build date: Mon Jul 27 10:06:04 2026 |
| Group: Unspecified | Build host: buildvm-a64-46.rdu3.fedoraproject.org |
| Size: 57143548 | Source RPM: cp2k-2026.2-3.fc45.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
* Fri Jul 24 2026 Cristian Le <git@lecris.dev> - 2026.2-3 - Cleanup the spec file * Tue Jul 21 2026 Cristian Le <git@lecris.dev> - 2026.2-2 - Drop march and mtune flags * Tue Jul 21 2026 Packit <hello@packit.dev> - 2026.2-1 - Update to 2026.2 upstream release * Wed Jul 15 2026 Fedora Release Engineering <releng@fedoraproject.org> - 2025.1-6 - Rebuilt for https://fedoraproject.org/wiki/Fedora_45_Mass_Rebuild * Fri Jan 16 2026 Fedora Release Engineering <releng@fedoraproject.org> - 2025.1-5 - Rebuilt for https://fedoraproject.org/wiki/Fedora_44_Mass_Rebuild * Fri Jan 16 2026 Fedora Release Engineering <releng@fedoraproject.org> - 2025.1-4 - Rebuilt for https://fedoraproject.org/wiki/Fedora_44_Mass_Rebuild * Wed Jul 23 2025 Fedora Release Engineering <releng@fedoraproject.org> - 2025.1-3 - Rebuilt for https://fedoraproject.org/wiki/Fedora_43_Mass_Rebuild * Fri Mar 07 2025 Ralf Corsépius <corsepiu@fedoraproject.org> - 2025.1-2 - Rebuild for scalapack SONAME change. * Thu Feb 13 2025 Packit <hello@packit.dev> - 2025.1-1 - Update to 2025.1 upstream release - Resolves: rhbz#2335153 * Thu Feb 06 2025 Cristian Le <git@lecris.dev> - 2024.3-4 - Rebuild with dbcsr 2.8.0 * Thu Jan 16 2025 Fedora Release Engineering <releng@fedoraproject.org> - 2024.3-3 - Rebuilt for https://fedoraproject.org/wiki/Fedora_42_Mass_Rebuild * 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
/usr/lib/.build-id /usr/lib/.build-id/2c /usr/lib/.build-id/2c/5041de06d1a019df06323477242e4ad85f317d /usr/lib/.build-id/2e /usr/lib/.build-id/2e/4fe5773a264ed6d1c3c086e9cca50a1d311333 /usr/lib/.build-id/40 /usr/lib/.build-id/40/d02ff824166525d617defba0047cf0d9291f05 /usr/lib/.build-id/79 /usr/lib/.build-id/79/d4db3260be636b76a77b5fd494465047a0ddf5 /usr/lib/.build-id/86 /usr/lib/.build-id/86/8bd4198e5d280ffe275b3f97a2004f83956791 /usr/lib/.build-id/89 /usr/lib/.build-id/89/1001e02293679ec3e3c2a82b941e571550efb4 /usr/lib/.build-id/d3 /usr/lib/.build-id/d3/24acd470f577a72cdd1fa5ca24bc00eab6e000 /usr/lib64/openmpi/bin/cp2k.popt /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.2026.2
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