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OpenMolcas-25.10-1.fc44 RPM for s390x

From Fedora Rawhide for s390x / o

Name: OpenMolcas Distribution: Fedora Project
Version: 25.10 Vendor: Fedora Project
Release: 1.fc44 Build date: Thu Oct 16 10:27:23 2025
Group: Unspecified Build host: buildvm-s390x-09.s390.fedoraproject.org
Size: 89430903 Source RPM: OpenMolcas-25.10-1.fc44.src.rpm
Packager: Fedora Project
Url: https://gitlab.com/Molcas/OpenMolcas
Summary: A multiconfigurational quantum chemistry software package
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

Requires

License

LicenseRef-Callaway-LGPLv2

Changelog

* 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.
* Thu Feb 15 2024 Susi Lehtola <jussilehtola@fedoraproject.org> - 24.02-1
  - Update to 24.02.
* Mon Jan 22 2024 Fedora Release Engineering <releng@fedoraproject.org> - 23.10-3
  - Rebuilt for https://fedoraproject.org/wiki/Fedora_40_Mass_Rebuild
* Fri Jan 19 2024 Fedora Release Engineering <releng@fedoraproject.org> - 23.10-2
  - Rebuilt for https://fedoraproject.org/wiki/Fedora_40_Mass_Rebuild
* Mon Oct 16 2023 Susi Lehtola <jussilehtola@fedoraproject.org> - 23.10-1
  - Update to release 23.10.

Files

/etc/profile.d/OpenMolcas.csh
/etc/profile.d/OpenMolcas.sh
/usr/bin/pymolcas
/usr/lib/.build-id
/usr/lib/.build-id/02
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/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
/usr/lib64/OpenMolcas/basis_library/5-21G
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/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/AUG-CC-PV5Z
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/usr/lib64/OpenMolcas/basis_library/AUG-CC-PVDZ
/usr/lib64/OpenMolcas/basis_library/AUG-CC-PVQZ
/usr/lib64/OpenMolcas/basis_library/AUG-CC-PVTZ
/usr/lib64/OpenMolcas/basis_library/AUG-PC-0
/usr/lib64/OpenMolcas/basis_library/AUG-PC-1
/usr/lib64/OpenMolcas/basis_library/AUG-PC-2
/usr/lib64/OpenMolcas/basis_library/AUG-PC-3
/usr/lib64/OpenMolcas/basis_library/AUG-PC-4
/usr/lib64/OpenMolcas/basis_library/CC-PV5Z
/usr/lib64/OpenMolcas/basis_library/CC-PV5Z-DK
/usr/lib64/OpenMolcas/basis_library/CC-PVDZ
/usr/lib64/OpenMolcas/basis_library/CC-PVDZ-DK
/usr/lib64/OpenMolcas/basis_library/CC-PVQZ
/usr/lib64/OpenMolcas/basis_library/CC-PVQZ-DK
/usr/lib64/OpenMolcas/basis_library/CC-PVTZ
/usr/lib64/OpenMolcas/basis_library/CC-PVTZ-DK
/usr/lib64/OpenMolcas/basis_library/CC-PWCV5Z-DK
/usr/lib64/OpenMolcas/basis_library/CC-PWCVQZ-DK
/usr/lib64/OpenMolcas/basis_library/CC-PWCVTZ-DK
/usr/lib64/OpenMolcas/basis_library/CG-AIMP
/usr/lib64/OpenMolcas/basis_library/DEF-SV-P
/usr/lib64/OpenMolcas/basis_library/DEF-SVP
/usr/lib64/OpenMolcas/basis_library/DEF-TZVP
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/usr/lib64/OpenMolcas/basis_library/EMB-AIMP
/usr/lib64/OpenMolcas/basis_library/JGAUSS-DZP
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/usr/lib64/OpenMolcas/basis_library/MCP-AQZP
/usr/lib64/OpenMolcas/basis_library/MCP-ATZP
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/usr/lib64/OpenMolcas/basis_library/MUONIC
/usr/lib64/OpenMolcas/basis_library/NP-AIMP
/usr/lib64/OpenMolcas/basis_library/NR-AIMP
/usr/lib64/OpenMolcas/basis_library/PC-0
/usr/lib64/OpenMolcas/basis_library/PC-1
/usr/lib64/OpenMolcas/basis_library/PC-2
/usr/lib64/OpenMolcas/basis_library/PC-3
/usr/lib64/OpenMolcas/basis_library/PC-4
/usr/lib64/OpenMolcas/basis_library/QRPLIB
/usr/lib64/OpenMolcas/basis_library/RAF-R
/usr/lib64/OpenMolcas/basis_library/RYDBERG
/usr/lib64/OpenMolcas/basis_library/SADLEJ_PVTZ
/usr/lib64/OpenMolcas/basis_library/SARC2-QZVP-DKH2
/usr/lib64/OpenMolcas/basis_library/STO-3G
/usr/lib64/OpenMolcas/basis_library/STUTTGART
/usr/lib64/OpenMolcas/basis_library/STUTTGART_NL
/usr/lib64/OpenMolcas/basis_library/basis.tbl
/usr/lib64/OpenMolcas/basis_library/basistype.tbl
/usr/lib64/OpenMolcas/basis_library/c_Basis
/usr/lib64/OpenMolcas/basis_library/c_Basis/DEF-SV-P
/usr/lib64/OpenMolcas/basis_library/c_Basis/DEF-SVP
/usr/lib64/OpenMolcas/basis_library/c_Basis/DEF-TZVP
/usr/lib64/OpenMolcas/basis_library/c_Basis/basis.tbl
/usr/lib64/OpenMolcas/basis_library/c_Basis/basistype.tbl
/usr/lib64/OpenMolcas/basis_library/c_Basis/trans.tbl
/usr/lib64/OpenMolcas/basis_library/j_Basis
/usr/lib64/OpenMolcas/basis_library/j_Basis/DEF-SV-P
/usr/lib64/OpenMolcas/basis_library/j_Basis/DEF-SVP
/usr/lib64/OpenMolcas/basis_library/j_Basis/DEF-TZVP
/usr/lib64/OpenMolcas/basis_library/j_Basis/basis.tbl
/usr/lib64/OpenMolcas/basis_library/j_Basis/basistype.tbl
/usr/lib64/OpenMolcas/basis_library/j_Basis/trans.tbl
/usr/lib64/OpenMolcas/basis_library/jk_Basis
/usr/lib64/OpenMolcas/basis_library/jk_Basis/CC-PVTZ
/usr/lib64/OpenMolcas/basis_library/jk_Basis/DEF-SV-P
/usr/lib64/OpenMolcas/basis_library/jk_Basis/DEF-SVP
/usr/lib64/OpenMolcas/basis_library/jk_Basis/basis.tbl
/usr/lib64/OpenMolcas/basis_library/jk_Basis/basistype.tbl
/usr/lib64/OpenMolcas/basis_library/jk_Basis/trans.tbl
/usr/lib64/OpenMolcas/basis_library/trans.tbl
/usr/lib64/OpenMolcas/bin
/usr/lib64/OpenMolcas/bin/alaska.exe
/usr/lib64/OpenMolcas/bin/averd.exe
/usr/lib64/OpenMolcas/bin/caspt2.exe
/usr/lib64/OpenMolcas/bin/casvb.exe
/usr/lib64/OpenMolcas/bin/ccsdt.exe
/usr/lib64/OpenMolcas/bin/chcc.exe
/usr/lib64/OpenMolcas/bin/cht3.exe
/usr/lib64/OpenMolcas/bin/cpf.exe
/usr/lib64/OpenMolcas/bin/dynamix.exe
/usr/lib64/OpenMolcas/bin/espf.exe
/usr/lib64/OpenMolcas/bin/expbas.exe
/usr/lib64/OpenMolcas/bin/extf.exe
/usr/lib64/OpenMolcas/bin/false.exe
/usr/lib64/OpenMolcas/bin/ffpt.exe
/usr/lib64/OpenMolcas/bin/gateway.exe
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Fabrice Bellet, Tue Oct 21 00:34:04 2025