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lammps-data-20230802.2-1.fc40 RPM for noarch

From Fedora 40 for ppc64le / l

Name: lammps-data Distribution: Fedora Project
Version: 20230802.2 Vendor: Fedora Project
Release: 1.fc40 Build date: Sat Feb 3 15:55:44 2024
Group: Unspecified Build host: buildhw-x86-01.iad2.fedoraproject.org
Size: 94638542 Source RPM: lammps-20230802.2-1.fc40.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.

Provides

Requires

License

GPLv2

Changelog

* 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
* Tue Sep 27 2022 Mamoru TASAKA <mtasaka@fedoraproject.org> - 20220623-3
  - Rebuild for kokkos 3.7
* Thu Jul 21 2022 Fedora Release Engineering <releng@fedoraproject.org> - 20220623-2
  - Rebuilt for https://fedoraproject.org/wiki/Fedora_37_Mass_Rebuild
* Thu Jun 23 2022 Richard Berger <richard.berger@outlook.com> - 20220623-1`
  - Version bump to 20220623
  - Added patch to fix unit test link error
  - Added patch to increase epsilon in some tests
  - Disable multiple unstable unit tests
  - Add new stl_bin2txt tool
* Mon Jun 13 2022 Python Maint <python-maint@redhat.com> - 20220217-3
  - Rebuilt for Python 3.11
* Wed Apr 27 2022 Christoph Junghans <junghans@votca.org> - 20220217-2
  - Rebuild for kokkos-3.6
* Fri Feb 18 2022 Richard Berger <richard.berger@outlook.com> - 20220217-1
  - Version bump to 20220217

Files

/etc/profile.d/lammps.csh
/etc/profile.d/lammps.sh
/usr/share/applications/lammps-shell.desktop
/usr/share/icons/hicolor
/usr/share/icons/hicolor/128x128
/usr/share/icons/hicolor/128x128/apps
/usr/share/icons/hicolor/128x128/apps/lammps.png
/usr/share/icons/hicolor/16x16
/usr/share/icons/hicolor/16x16/apps
/usr/share/icons/hicolor/16x16/apps/lammps.png
/usr/share/icons/hicolor/22x22
/usr/share/icons/hicolor/22x22/apps
/usr/share/icons/hicolor/22x22/apps/lammps.png
/usr/share/icons/hicolor/32x32
/usr/share/icons/hicolor/32x32/apps
/usr/share/icons/hicolor/32x32/apps/lammps.png
/usr/share/icons/hicolor/48x48
/usr/share/icons/hicolor/48x48/apps
/usr/share/icons/hicolor/48x48/apps/lammps.png
/usr/share/icons/hicolor/64x64
/usr/share/icons/hicolor/64x64/apps
/usr/share/icons/hicolor/64x64/apps/lammps.png
/usr/share/icons/lammps.ico
/usr/share/icons/lmpfile.ico
/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
/usr/share/lammps/bench/POTENTIALS/in.spce
/usr/share/lammps/bench/POTENTIALS/in.sw
/usr/share/lammps/bench/POTENTIALS/in.tersoff
/usr/share/lammps/bench/POTENTIALS/library.meam
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.adp.1
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.adp.4
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.airebo.1
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.airebo.4
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.bop.1
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.bop.4
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.comb.1
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.comb.4
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.dpd.1
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.dpd.4
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.eam.1
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.eam.4
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.eff.1
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.eff.4
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.eim.1
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.eim.4
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.fene.1
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.fene.4
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.gb.1
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.gb.4
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.granular.1
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.granular.4
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.lj.1
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.lj.4
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.meam.1
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.meam.4
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.peri.1
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.peri.4
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.protein.1
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.protein.4
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.reaxc.1
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.reaxc.4
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.rebo.1
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.rebo.4
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.spce.1
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.spce.4
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.sw.1
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.sw.4
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.tersoff.1
/usr/share/lammps/bench/POTENTIALS/log.9Oct20.tersoff.4
/usr/share/lammps/bench/README
/usr/share/lammps/bench/data.chain
/usr/share/lammps/bench/data.chute
/usr/share/lammps/bench/data.rhodo
/usr/share/lammps/bench/in.chain
/usr/share/lammps/bench/in.chain.scaled
/usr/share/lammps/bench/in.chute
/usr/share/lammps/bench/in.chute.scaled
/usr/share/lammps/bench/in.eam
/usr/share/lammps/bench/in.lj
/usr/share/lammps/bench/in.rhodo
/usr/share/lammps/bench/in.rhodo.scaled
/usr/share/lammps/bench/log.6Oct16.chain.fixed.icc.1
/usr/share/lammps/bench/log.6Oct16.chain.fixed.icc.4
/usr/share/lammps/bench/log.6Oct16.chain.scaled.icc.4
/usr/share/lammps/bench/log.6Oct16.chute.fixed.icc.1
/usr/share/lammps/bench/log.6Oct16.chute.fixed.icc.4
/usr/share/lammps/bench/log.6Oct16.chute.scaled.icc.4
/usr/share/lammps/bench/log.6Oct16.eam.fixed.icc.1
/usr/share/lammps/bench/log.6Oct16.eam.fixed.icc.4
/usr/share/lammps/bench/log.6Oct16.eam.scaled.icc.4
/usr/share/lammps/bench/log.6Oct16.lj.fixed.icc.1
/usr/share/lammps/bench/log.6Oct16.lj.fixed.icc.4
/usr/share/lammps/bench/log.6Oct16.lj.scaled.icc.4
/usr/share/lammps/bench/log.6Oct16.rhodo.fixed.icc.1
/usr/share/lammps/bench/log.6Oct16.rhodo.fixed.icc.4
/usr/share/lammps/bench/log.6Oct16.rhodo.scaled.icc.4
/usr/share/lammps/frc_files
/usr/share/lammps/frc_files/README
/usr/share/lammps/frc_files/cff91.frc
/usr/share/lammps/frc_files/clayff.frc
/usr/share/lammps/frc_files/compass_published.frc
/usr/share/lammps/frc_files/cvff.frc
/usr/share/lammps/frc_files/cvff_aug.frc
/usr/share/lammps/frc_files/oplsaa.frc
/usr/share/lammps/frc_files/pcff.frc
/usr/share/lammps/frc_files/pcff.rlb
/usr/share/lammps/frc_files/pcff_templates.dat
/usr/share/lammps/potentials
/usr/share/lammps/potentials/Ag_u3.eam
/usr/share/lammps/potentials/AlCu.adp
/usr/share/lammps/potentials/AlCu.bop.table
/usr/share/lammps/potentials/AlCu.eam.alloy
/usr/share/lammps/potentials/AlCuH.bop.table
/usr/share/lammps/potentials/AlFe_mm.eam.fs
/usr/share/lammps/potentials/AlO.eam.alloy
/usr/share/lammps/potentials/AlO.streitz
/usr/share/lammps/potentials/AlSiMgCuFe.meam
/usr/share/lammps/potentials/Al_Batra_2019.agni
/usr/share/lammps/potentials/Al_jnp.eam
/usr/share/lammps/potentials/Al_jpc.agni
/usr/share/lammps/potentials/Al_mm.eam.fs
/usr/share/lammps/potentials/Al_prb.agni
/usr/share/lammps/potentials/Al_zhou.eam.alloy
/usr/share/lammps/potentials/Au_u3.eam
/usr/share/lammps/potentials/BN.extep
/usr/share/lammps/potentials/BNC.tersoff
/usr/share/lammps/potentials/BNCH-old.ILP
/usr/share/lammps/potentials/BNCH.ILP
/usr/share/lammps/potentials/BNC_MBD_bulk.ILP
/usr/share/lammps/potentials/BNC_TS_bulk.ILP
/usr/share/lammps/potentials/Bi.meam
/usr/share/lammps/potentials/C.drip
/usr/share/lammps/potentials/C.lcbop
/usr/share/lammps/potentials/CC.KC
/usr/share/lammps/potentials/CC.KC-full
/usr/share/lammps/potentials/CC.Lebedeva
/usr/share/lammps/potentials/CCu_v2.bop.table
/usr/share/lammps/potentials/CH.KC
/usr/share/lammps/potentials/CH.airebo
/usr/share/lammps/potentials/CH.airebo-m
/usr/share/lammps/potentials/CH.rebo
/usr/share/lammps/potentials/CHAu.ILP
/usr/share/lammps/potentials/CH_taper.KC
/usr/share/lammps/potentials/COH.DMC.aip.water.2dm
/usr/share/lammps/potentials/COH.aip.water.2dm
/usr/share/lammps/potentials/C_SNAP_2021.10.15.quadratic.snapcoeff
/usr/share/lammps/potentials/C_SNAP_2021.10.15.quadratic.snapparam
/usr/share/lammps/potentials/CdTe.bop.table
/usr/share/lammps/potentials/CdTe.sw
/usr/share/lammps/potentials/CdTeSe.bop.table
/usr/share/lammps/potentials/CdTeZn.bop.table
/usr/share/lammps/potentials/CdTeZnSeHgS0.sw
/usr/share/lammps/potentials/CdZnTe_v1.bop.table
/usr/share/lammps/potentials/CdZnTe_v2.bop.table
/usr/share/lammps/potentials/CoAl.eam.alloy
/usr/share/lammps/potentials/Cu-PBE-core-rep.ace
/usr/share/lammps/potentials/Cu.meam
/usr/share/lammps/potentials/Cu.nn.mliap.model
/usr/share/lammps/potentials/Cu.snap.mliap.descriptor
/usr/share/lammps/potentials/CuH.bop.table
/usr/share/lammps/potentials/CuNi.eam.alloy
/usr/share/lammps/potentials/CuTa.eam.alloy
/usr/share/lammps/potentials/CuTa_eam.poly
/usr/share/lammps/potentials/CuZr_mm.eam.fs
/usr/share/lammps/potentials/Cu_Huan_2019_fp1.agni
/usr/share/lammps/potentials/Cu_Huan_2019_fp2.agni
/usr/share/lammps/potentials/Cu_Zuo_JPCA2020.quadratic.snap
/usr/share/lammps/potentials/Cu_Zuo_JPCA2020.quadratic.snapcoeff
/usr/share/lammps/potentials/Cu_Zuo_JPCA2020.quadratic.snapparam
/usr/share/lammps/potentials/Cu_Zuo_JPCA2020.snap
/usr/share/lammps/potentials/Cu_Zuo_JPCA2020.snapcoeff
/usr/share/lammps/potentials/Cu_Zuo_JPCA2020.snapparam
/usr/share/lammps/potentials/Cu_mishin1.eam.alloy
/usr/share/lammps/potentials/Cu_smf7.eam
/usr/share/lammps/potentials/Cu_u3.eam
/usr/share/lammps/potentials/Cu_u6.eam
/usr/share/lammps/potentials/Cu_zhou.eam.alloy
/usr/share/lammps/potentials/FeCH_BOP_I.poly
/usr/share/lammps/potentials/FeCH_BOP_II.poly
/usr/share/lammps/potentials/FeCr.cdeam
/usr/share/lammps/potentials/FeP_mm.eam.fs
/usr/share/lammps/potentials/Fe_mm.eam.fs
/usr/share/lammps/potentials/GaAs.bop.table
/usr/share/lammps/potentials/GaN.sw
/usr/share/lammps/potentials/GaN.tersoff
/usr/share/lammps/potentials/GaN_sw.poly
/usr/share/lammps/potentials/GaN_tersoff.poly
/usr/share/lammps/potentials/Ge.tersoff
/usr/share/lammps/potentials/Ge_Zuo_JPCA2020.quadratic.snap
/usr/share/lammps/potentials/Ge_Zuo_JPCA2020.quadratic.snapcoeff
/usr/share/lammps/potentials/Ge_Zuo_JPCA2020.quadratic.snapparam
/usr/share/lammps/potentials/Ge_Zuo_JPCA2020.snap
/usr/share/lammps/potentials/Ge_Zuo_JPCA2020.snapcoeff
/usr/share/lammps/potentials/Ge_Zuo_JPCA2020.snapparam
/usr/share/lammps/potentials/HGa.msmeam
/usr/share/lammps/potentials/He_He_JW2013.table
/usr/share/lammps/potentials/InP.vashishta
/usr/share/lammps/potentials/InP_JCPA2020.mliap
/usr/share/lammps/potentials/InP_JCPA2020.mliap.descriptor
/usr/share/lammps/potentials/InP_JCPA2020.mliap.model
/usr/share/lammps/potentials/InP_JCPA2020.snap
/usr/share/lammps/potentials/InP_JCPA2020.snapcoeff
/usr/share/lammps/potentials/InP_JCPA2020.snapparam
/usr/share/lammps/potentials/Li_Zuo_JPCA2020.quadratic.snap
/usr/share/lammps/potentials/Li_Zuo_JPCA2020.quadratic.snapcoeff
/usr/share/lammps/potentials/Li_Zuo_JPCA2020.quadratic.snapparam
/usr/share/lammps/potentials/Li_Zuo_JPCA2020.snap
/usr/share/lammps/potentials/Li_Zuo_JPCA2020.snapcoeff
/usr/share/lammps/potentials/Li_Zuo_JPCA2020.snapparam
/usr/share/lammps/potentials/MOH.nb3b.harmonic
/usr/share/lammps/potentials/MgAl.rann
/usr/share/lammps/potentials/Mg_mm.eam.fs
/usr/share/lammps/potentials/Mo5.2.mgpt.README
/usr/share/lammps/potentials/Mo5.2.mgpt.parmin
/usr/share/lammps/potentials/Mo5.2.mgpt.potin
/usr/share/lammps/potentials/MoS2.ILP
/usr/share/lammps/potentials/Mo_Chen_PRM2017.snap
/usr/share/lammps/potentials/Mo_Chen_PRM2017.snapcoeff
/usr/share/lammps/potentials/Mo_Chen_PRM2017.snapparam
/usr/share/lammps/potentials/Mo_Zuo_JPCA2020.quadratic.snap
/usr/share/lammps/potentials/Mo_Zuo_JPCA2020.quadratic.snapcoeff
/usr/share/lammps/potentials/Mo_Zuo_JPCA2020.quadratic.snapparam
/usr/share/lammps/potentials/Mo_Zuo_JPCA2020.snap
/usr/share/lammps/potentials/Mo_Zuo_JPCA2020.snapcoeff
/usr/share/lammps/potentials/Mo_Zuo_JPCA2020.snapparam
/usr/share/lammps/potentials/Ni.adp
/usr/share/lammps/potentials/Ni.meam
/usr/share/lammps/potentials/NiAlH_jea.eam.alloy
/usr/share/lammps/potentials/NiAlH_jea.eam.fs
/usr/share/lammps/potentials/Ni_Mo.mliap.descriptor
/usr/share/lammps/potentials/Ni_Mo.mliap.model
/usr/share/lammps/potentials/Ni_Zuo_JPCA2020.quadratic.snap
/usr/share/lammps/potentials/Ni_Zuo_JPCA2020.quadratic.snapcoeff
/usr/share/lammps/potentials/Ni_Zuo_JPCA2020.quadratic.snapparam
/usr/share/lammps/potentials/Ni_Zuo_JPCA2020.snap
/usr/share/lammps/potentials/Ni_Zuo_JPCA2020.snapcoeff
/usr/share/lammps/potentials/Ni_Zuo_JPCA2020.snapparam
/usr/share/lammps/potentials/Ni_smf7.eam
/usr/share/lammps/potentials/Ni_u3.eam
/usr/share/lammps/potentials/PdHHe.eam.he
/usr/share/lammps/potentials/Pd_u3.eam
/usr/share/lammps/potentials/Pt_Chapman_2020.agni
/usr/share/lammps/potentials/Pt_u3.eam
/usr/share/lammps/potentials/README
/usr/share/lammps/potentials/README.reax
/usr/share/lammps/potentials/Si.b.meam.sw.spline
/usr/share/lammps/potentials/Si.edip
/usr/share/lammps/potentials/Si.nn.mliap.descriptor
/usr/share/lammps/potentials/Si.nn.mliap.model
/usr/share/lammps/potentials/Si.sw
/usr/share/lammps/potentials/Si.tersoff
/usr/share/lammps/potentials/Si.tersoff.mod
/usr/share/lammps/potentials/Si.tersoff.modc
/usr/share/lammps/potentials/SiC.edip
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Fabrice Bellet, Tue Jul 9 23:56:58 2024