OpenMolcas-26.02-3.fc45 RPM for x86_64

From Fedora Rawhide for x86_64 / o

OpenMolcas is a quantum chemistry software package developed by
scientists and intended to be used by scientists. It includes programs
to apply many different electronic structure methods to chemical
systems, but its key feature is the multiconfigurational approach,
with methods like CASSCF and CASPT2.

OpenMolcas is not a fork or reimplementation of Molcas, it is a large
part of the Molcas codebase that has been released as free and
open-source software (FOSS) under the Lesser GNU Public License
(LGPL). Some parts of Molcas remain under a different license by
decision of their authors (or impossibility to reach them), and are
therefore not included in OpenMolcas.

Provides

• OpenMolcas
• OpenMolcas(x86-64)
• libalaska.so()(64bit)
• libaverd.so()(64bit)
• libcaspt2.so()(64bit)
• libcasvb.so()(64bit)
• libccsdt.so()(64bit)
• libchcc.so()(64bit)
• libcht3.so()(64bit)
• libcpf.so()(64bit)
• libdynamix.so()(64bit)
• libexpbas.so()(64bit)
• libextf.so()(64bit)
• libfalse.so()(64bit)
• libffpt.so()(64bit)
• libgateway.so()(64bit)
• libgenano.so()(64bit)
• libgrid_it.so()(64bit)
• libguessorb.so()(64bit)
• libguga.so()(64bit)
• libgugaci.so()(64bit)
• libgugadrt.so()(64bit)
• liblast_energy.so()(64bit)
• liblevel.so()(64bit)
• liblocalisation.so()(64bit)
• libloprop.so()(64bit)
• libmbpt2.so()(64bit)
• libmckinley.so()(64bit)
• libmclr.so()(64bit)
• libmcpdft.so()(64bit)
• libmolcas.so()(64bit)
• libmotra.so()(64bit)
• libmpprop.so()(64bit)
• libmrci.so()(64bit)
• libmula.so()(64bit)
• libnumerical_gradient.so()(64bit)
• libpoly_aniso.so()(64bit)
• libqmstat.so()(64bit)
• libquater.so()(64bit)
• librasscf.so()(64bit)
• librassi.so()(64bit)
• librhodyn.so()(64bit)
• librpa.so()(64bit)
• libscf.so()(64bit)
• libseward.so()(64bit)
• libsingle_aniso.so()(64bit)
• libslapaf.so()(64bit)
• libsurfacehop.so()(64bit)
• libvibrot.so()(64bit)

Requires

• /usr/bin/bash
• /usr/bin/python3
• CheMPS2
• glibc >= 2.43.9000-11
• libalaska.so()(64bit)
• libaverd.so()(64bit)
• libc.so.6()(64bit)
• libc.so.6(GLIBC_2.14)(64bit)
• libc.so.6(GLIBC_2.2.5)(64bit)
• libc.so.6(GLIBC_2.3)(64bit)
• libc.so.6(GLIBC_2.3.3)(64bit)
• libc.so.6(GLIBC_2.3.4)(64bit)
• libc.so.6(GLIBC_2.33)(64bit)
• libc.so.6(GLIBC_2.34)(64bit)
• libc.so.6(GLIBC_2.4)(64bit)
• libc.so.6(GLIBC_ABI_DT_RELR)(64bit)
• libcaspt2.so()(64bit)
• libcasvb.so()(64bit)
• libccsdt.so()(64bit)
• libchcc.so()(64bit)
• libcht3.so()(64bit)
• libcpf.so()(64bit)
• libdynamix.so()(64bit)
• libexpbas.so()(64bit)
• libextf.so()(64bit)
• libfalse.so()(64bit)
• libffpt.so()(64bit)
• libflexiblas64.so.3()(64bit)
• libgateway.so()(64bit)
• libgcc_s.so.1()(64bit)
• libgenano.so()(64bit)
• libgfortran.so.5()(64bit)
• libgfortran.so.5(GFORTRAN_10)(64bit)
• libgfortran.so.5(GFORTRAN_8)(64bit)
• libgomp.so.1()(64bit)
• libgomp.so.1(OMP_1.0)(64bit)
• libgomp.so.1(OMP_3.0)(64bit)
• libgrid_it.so()(64bit)
• libguessorb.so()(64bit)
• libguga.so()(64bit)
• libgugaci.so()(64bit)
• libgugadrt.so()(64bit)
• libhdf5.so.320()(64bit)
• liblast_energy.so()(64bit)
• liblevel.so()(64bit)
• liblocalisation.so()(64bit)
• libloprop.so()(64bit)
• libm.so.6()(64bit)
• libm.so.6(GLIBC_2.2.5)(64bit)
• libm.so.6(GLIBC_2.29)(64bit)
• libm.so.6(GLIBC_2.44)(64bit)
• libmbpt2.so()(64bit)
• libmckinley.so()(64bit)
• libmclr.so()(64bit)
• libmcpdft.so()(64bit)
• libmolcas.so()(64bit)
• libmotra.so()(64bit)
• libmpprop.so()(64bit)
• libmrci.so()(64bit)
• libmula.so()(64bit)
• libmvec.so.1()(64bit)
• libmvec.so.1(GLIBC_2.22)(64bit)
• libmvec.so.1(GLIBC_2.35)(64bit)
• libnumerical_gradient.so()(64bit)
• libpoly_aniso.so()(64bit)
• libqmstat.so()(64bit)
• libquater.so()(64bit)
• librasscf.so()(64bit)
• librassi.so()(64bit)
• librhodyn.so()(64bit)
• librpa.so()(64bit)
• libscf.so()(64bit)
• libseward.so()(64bit)
• libsingle_aniso.so()(64bit)
• libslapaf.so()(64bit)
• libsurfacehop.so()(64bit)
• libvibrot.so()(64bit)
• libxcf03.so.15()(64bit)
• python3-pyparsing
• python3-setuptools
• rpmlib(CompressedFileNames) <= 3.0.4-1
• rpmlib(FileDigests) <= 4.6.0-1
• rpmlib(PartialHardlinkSets) <= 4.0.4-1
• rpmlib(PayloadFilesHavePrefix) <= 4.0-1
• rpmlib(PayloadIsZstd) <= 5.4.18-1
• rtld(GNU_HASH)

License

LGPL-2.1-only

Changelog

* Sat Apr 18 2026 Cristian Le <git@lecris.dev> - 26.02-3
  - Use standard CMake macros (rhbz#2380964)
  - Remove various dead %if checks
  - Use shebang fix macro
* Fri Apr 17 2026 Orion Poplawski <orion@nwra.com> - 26.02-2
  - Rebuild for hdf5 2.1
* Mon Feb 16 2026 Susi Lehtola <jussilehtola@fedoraproject.org> - 26.02-1
  - Update to 26.02.
* Fri Jan 16 2026 Fedora Release Engineering <releng@fedoraproject.org> - 25.10-3
  - Rebuilt for https://fedoraproject.org/wiki/Fedora_44_Mass_Rebuild
* Fri Jan 16 2026 Fedora Release Engineering <releng@fedoraproject.org> - 25.10-2
  - Rebuilt for https://fedoraproject.org/wiki/Fedora_44_Mass_Rebuild
* Wed Oct 15 2025 Susi Lehtola <jussilehtola@fedoraproject.org> - 25.10-1
  - Update to 25.10.
* Wed Jul 23 2025 Fedora Release Engineering <releng@fedoraproject.org> - 25.06-2
  - Rebuilt for https://fedoraproject.org/wiki/Fedora_43_Mass_Rebuild
* Mon Jun 16 2025 Susi Lehtola <jussilehtola@fedoraproject.org> - 25.06-1
  - Update to 25.06.
* Sat Feb 15 2025 Susi Lehtola <jussilehtola@fedoraproject.org> - 25.02-1
  - Update to 25.02.
* Thu Jan 16 2025 Fedora Release Engineering <releng@fedoraproject.org> - 24.10-3
  - Rebuilt for https://fedoraproject.org/wiki/Fedora_42_Mass_Rebuild
* Fri Oct 25 2024 Orion Poplawski <orion@nwra.com> - 24.10-2
  - Rebuild for hdf5 1.14.5
* Tue Oct 15 2024 Susi Lehtola <jussilehtola@fedoraproject.org> - 24.10-1
  - Update to 24.10.
* Mon Sep 02 2024 Miroslav Suchý <msuchy@redhat.com> - 24.06-3
  - convert license to SPDX
* Wed Jul 17 2024 Fedora Release Engineering <releng@fedoraproject.org> - 24.06-2
  - Rebuilt for https://fedoraproject.org/wiki/Fedora_41_Mass_Rebuild
* Sat Jun 15 2024 Susi Lehtola <jussilehtola@fedoraproject.org> - 24.06-1
  - Update to 24.06.

Files

/etc/profile.d/OpenMolcas.csh
/etc/profile.d/OpenMolcas.sh
/usr/bin/pymolcas
/usr/lib/.build-id
/usr/lib/.build-id/01
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/usr/lib64/OpenMolcas
/usr/lib64/OpenMolcas/.molcashome
/usr/lib64/OpenMolcas/.molcasversion
/usr/lib64/OpenMolcas/CONTRIBUTORS.md
/usr/lib64/OpenMolcas/LICENSE
/usr/lib64/OpenMolcas/basis_library
/usr/lib64/OpenMolcas/basis_library/3-21G
/usr/lib64/OpenMolcas/basis_library/4-31G
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/usr/lib64/OpenMolcas/basis_library/6-31Gpp
/usr/lib64/OpenMolcas/basis_library/AHLRICHS_VDZ
/usr/lib64/OpenMolcas/basis_library/AHLRICHS_VTZ
/usr/lib64/OpenMolcas/basis_library/AIMP.README
/usr/lib64/OpenMolcas/basis_library/ANO-DK3
/usr/lib64/OpenMolcas/basis_library/ANO-L
/usr/lib64/OpenMolcas/basis_library/ANO-ORCA
/usr/lib64/OpenMolcas/basis_library/ANO-R
/usr/lib64/OpenMolcas/basis_library/ANO-RCC
/usr/lib64/OpenMolcas/basis_library/ANO-RCC.README
/usr/lib64/OpenMolcas/basis_library/ANO-S
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/usr/lib64/OpenMolcas/basis_library/CC-PV5Z-DK
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Fabrice Bellet, Mon Jul 20 22:21:06 2026