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| Name: lammps-data | Distribution: Fedora Project |
| Version: 20241119 | Vendor: Fedora Project |
| Release: 2.fc42 | Build date: Sat Dec 7 05:46:43 2024 |
| Group: Unspecified | Build host: buildvm-x86-12.iad2.fedoraproject.org |
| Size: 96455654 | Source RPM: lammps-20241119-2.fc42.src.rpm |
| Packager: Fedora Project | |
| Url: https://www.lammps.org/ | |
| Summary: Data files for LAMMPS | |
LAMMPS is a classical molecular dynamics code, and an acronym for Large-scale Atomic/Molecular Massively Parallel Simulator. LAMMPS has potentials for soft materials (biomolecules, polymers) and solid-state materials (metals, semiconductors) and coarse-grained or mesoscopic systems. It can be used to model atoms or, more generically, as a parallel particle simulator at the atomic, meso, or continuum scale. LAMMPS runs on single processors or in parallel using message-passing techniques and a spatial-decomposition of the simulation domain. The code is designed to be easy to modify or extend with new functionality. This package contains data files for LAMMPS.
GPL-2.0-only
* Tue Dec 03 2024 Christoph Junghans <junghans@votca.org> - 20241119-2 - Enable heffte support * Sat Nov 30 2024 Richard Berger <richard.berger@outlook.com> - 20241119-1 - Version bump to 20241119 - First release that makes use of Kokkos 4.4.01 - Dropped detect_mpi4py_v4.patch. got merged upstream * Fri Oct 25 2024 Orion Poplawski <orion@nwra.com> - 20240829-2 - Rebuild for hdf5 1.14.5 * Fri Sep 20 2024 Richard Berger <richard.berger@outlook.com> - 20240829-1 - Version bump to 20240829 - Re-enable Kokkos - Prevent sourcing of modules.sh to stop due to error - Remove lammps-shell - Disable unstable tests - Add patch for mpi4py 4 support * Mon Jul 29 2024 Miroslav Suchý <msuchy@redhat.com> - 20230802.2-4 - convert license to SPDX * Thu Jul 18 2024 Fedora Release Engineering <releng@fedoraproject.org> - 20230802.2-3 - Rebuilt for https://fedoraproject.org/wiki/Fedora_41_Mass_Rebuild * Sat Jun 08 2024 Python Maint <python-maint@redhat.com> - 20230802.2-2 - Rebuilt for Python 3.13 * Sat Feb 03 2024 Richard Berger <richard.berger@outlook.com> - 20230802.2-1 - Version bump to 20230802.2 * Thu Feb 01 2024 Richard Berger <richard.berger@outlook.com> - 20230802.1-4 - Remove non-existant build dependencies from 32bit builds * Thu Jan 25 2024 Fedora Release Engineering <releng@fedoraproject.org> - 20230802.1-3 - Rebuilt for https://fedoraproject.org/wiki/Fedora_40_Mass_Rebuild * Sun Jan 21 2024 Fedora Release Engineering <releng@fedoraproject.org> - 20230802.1-2 - Rebuilt for https://fedoraproject.org/wiki/Fedora_40_Mass_Rebuild * Sun Nov 05 2023 Richard Berger <richard.berger@outlook.com> - 20230802.1-1 - Version bump to 20230802.1 - Disable potentials download during CMake (DOWNLOAD_POTENTIALS=OFF) - Disable deprecated MPIIO package - Remove CMake patch - Add missing spglib to sources - Disable some more tests on non-x86 * Wed Jul 26 2023 Christoph Junghans <junghans@votca.org> - Re-enable serial lammps on ix86 * Thu Jul 20 2023 Fedora Release Engineering <releng@fedoraproject.org> - 20220623.4-3 - Rebuilt for https://fedoraproject.org/wiki/Fedora_39_Mass_Rebuild * Sun Jul 02 2023 Python Maint <python-maint@redhat.com> - 20220623.4-2 - Rebuilt for Python 3.12 * Wed Jun 28 2023 Richard Berger <richard.berger@outlook.com> - 20220623.4-1` - Version bump to 20220623.4, disable more tests, and update patch * Thu Jun 15 2023 Python Maint <python-maint@redhat.com> - 20220623.3-3 - Rebuilt for Python 3.12 * Mon May 15 2023 Christoph Junghans <junghans@votca.org> - 20220623.3-2 - disable kokkos on rawhide for now * Mon Feb 20 2023 Richard Berger <richard.berger@outlook.com> - 20220623.3-1` - Version bump to 20220623.3 * Thu Jan 19 2023 Fedora Release Engineering <releng@fedoraproject.org> - 20220623-4 - Rebuilt for https://fedoraproject.org/wiki/Fedora_38_Mass_Rebuild
/etc/profile.d/lammps.csh /etc/profile.d/lammps.sh /usr/share/lammps /usr/share/lammps/bench /usr/share/lammps/bench/Cu_u3.eam /usr/share/lammps/bench/POTENTIALS /usr/share/lammps/bench/POTENTIALS/CH.airebo /usr/share/lammps/bench/POTENTIALS/CH.rebo /usr/share/lammps/bench/POTENTIALS/CdTe.bop.table /usr/share/lammps/bench/POTENTIALS/Cu_u3.eam /usr/share/lammps/bench/POTENTIALS/Ni.adp /usr/share/lammps/bench/POTENTIALS/Ni.meam /usr/share/lammps/bench/POTENTIALS/README /usr/share/lammps/bench/POTENTIALS/Si.sw /usr/share/lammps/bench/POTENTIALS/Si.tersoff /usr/share/lammps/bench/POTENTIALS/data.airebo /usr/share/lammps/bench/POTENTIALS/data.comb /usr/share/lammps/bench/POTENTIALS/data.eff /usr/share/lammps/bench/POTENTIALS/data.eim /usr/share/lammps/bench/POTENTIALS/data.fene /usr/share/lammps/bench/POTENTIALS/data.gb /usr/share/lammps/bench/POTENTIALS/data.granular /usr/share/lammps/bench/POTENTIALS/data.protein /usr/share/lammps/bench/POTENTIALS/data.reax /usr/share/lammps/bench/POTENTIALS/data.rebo /usr/share/lammps/bench/POTENTIALS/data.spce /usr/share/lammps/bench/POTENTIALS/ffield.comb /usr/share/lammps/bench/POTENTIALS/ffield.eim /usr/share/lammps/bench/POTENTIALS/ffield.reax /usr/share/lammps/bench/POTENTIALS/in.adp /usr/share/lammps/bench/POTENTIALS/in.airebo /usr/share/lammps/bench/POTENTIALS/in.bop /usr/share/lammps/bench/POTENTIALS/in.comb /usr/share/lammps/bench/POTENTIALS/in.dpd /usr/share/lammps/bench/POTENTIALS/in.eam /usr/share/lammps/bench/POTENTIALS/in.eff /usr/share/lammps/bench/POTENTIALS/in.eim /usr/share/lammps/bench/POTENTIALS/in.fene /usr/share/lammps/bench/POTENTIALS/in.gb /usr/share/lammps/bench/POTENTIALS/in.granular /usr/share/lammps/bench/POTENTIALS/in.lj /usr/share/lammps/bench/POTENTIALS/in.meam /usr/share/lammps/bench/POTENTIALS/in.peri /usr/share/lammps/bench/POTENTIALS/in.protein /usr/share/lammps/bench/POTENTIALS/in.reaxc /usr/share/lammps/bench/POTENTIALS/in.rebo 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Fabrice Bellet, Thu Dec 26 01:09:01 2024