nwchem-openmpi-7.3.1-5.fc46 RPM for ppc64le

From Fedora Rawhide for ppc64le / n

NWChem aims to provide its users with computational chemistry tools that are
scalable both in their ability to treat large scientific computational
chemistry problems efficiently, and in their use of available parallel
computing resources from high-performance parallel supercomputers to
conventional workstation clusters.

Please cite the following reference when
publishing results obtained with NWChem:
M. Valiev, E.J. Bylaska, N. Govind, K. Kowalski, T.P. Straatsma,
H.J.J. van Dam, D. Wang, J. Nieplocha, E. Apra, T.L. Windus, W.A. de Jong,
"NWChem: a comprehensive and scalable open-source solution for
large scale molecular simulations" Comput. Phys. Commun. 181, 1477 (2010)

This package contains the openmpi version.

Provides

• nwchem-openmpi
• nwchem-openmpi(ppc-64)

Requires

• /usr/bin/bash
• libarmci.so.0()(64bit)(openmpi-ppc64le)
• libc.so.6()(64bit)
• libc.so.6(GLIBC_2.17)(64bit)
• libc.so.6(GLIBC_2.32)(64bit)
• libc.so.6(GLIBC_2.33)(64bit)
• libc.so.6(GLIBC_2.34)(64bit)
• libc.so.6(GLIBC_2.38)(64bit)
• libcomex.so.0()(64bit)(openmpi-ppc64le)
• libflexiblas.so.3()(64bit)
• libga.so.1()(64bit)(openmpi-ppc64le)
• libgcc_s.so.1()(64bit)
• libgfortran.so.5()(64bit)
• libgfortran.so.5(GFORTRAN_10)(64bit)
• libgfortran.so.5(GFORTRAN_8)(64bit)
• libm.so.6()(64bit)
• libm.so.6(GLIBC_2.17)(64bit)
• libm.so.6(GLIBC_2.27)(64bit)
• libm.so.6(GLIBC_2.29)(64bit)
• libm.so.6(GLIBC_2.44)(64bit)
• libmpi.so.40()(64bit)(openmpi-ppc64le)
• libmpi_mpifh.so.40()(64bit)(openmpi-ppc64le)
• libmpi_usempi_ignore_tkr.so.40()(64bit)(openmpi-ppc64le)
• libmpi_usempif08.so.40()(64bit)(openmpi-ppc64le)
• libpython3.15.so.1.0()(64bit)
• libscalapack.so.2.2()(64bit)(openmpi-ppc64le)
• libxc.so.15()(64bit)
• libxcf03.so.15()(64bit)
• nwchem = 7.3.1-5.fc46
• openmpi
• rpmlib(CompressedFileNames) <= 3.0.4-1
• rpmlib(FileDigests) <= 4.6.0-1
• rpmlib(PayloadFilesHavePrefix) <= 4.0-1
• rpmlib(PayloadIsZstd) <= 5.4.18-1
• rtld(GNU_HASH)

License

ECL-2.0

Changelog

* Tue Oct 27 2026 Zbigniew Jędrzejewski-Szmek <zbyszek@in.waw.pl> - 7.3.1-5
  - Rebuilt for mpich-5.0.2
* Wed Jul 22 2026 Python Maint <python-maint@redhat.com> - 7.3.1-4
  - Rebuilt for Python 3.15.0b4 ABI change
* Thu Jul 16 2026 Fedora Release Engineering <releng@fedoraproject.org> - 7.3.1-3
  - Rebuilt for https://fedoraproject.org/wiki/Fedora_45_Mass_Rebuild
* Wed Jun 03 2026 Python Maint <python-maint@redhat.com> - 7.3.1-2
  - Rebuilt for Python 3.15
* Thu Jan 15 2026 Marcin Dulak <marcindulak@fedoraproject.org> - 7.3.1-1
  - New upstream release
* Sat Oct 25 2025 Marcin Dulak <marcindulak@fedoraproject.org> - 7.3.0-1
  - New upstream release
* Thu Jul 24 2025 Fedora Release Engineering <releng@fedoraproject.org> - 7.2.3-7
  - Rebuilt for https://fedoraproject.org/wiki/Fedora_43_Mass_Rebuild
* Tue Jun 03 2025 Python Maint <python-maint@redhat.com> - 7.2.3-6
  - Rebuilt for Python 3.14
* Fri Mar 07 2025 Ralf Corsépius <corsepiu@fedoraproject.org> - 7.2.3-5
  - Rebuild for scalapack SONAME change.
* Mon Feb 17 2025 Marcin Dulak <marcindulak@fedoraproject.org> - 7.2.3-4
  - Patch for gcc-15 "error: expected identifier or '(' before 'false'"
  - Use gcc -std=gnu17 to avoid md5wrap.c:48:5: error: too many arguments to function ‘MD5Init’
* Fri Jan 17 2025 Fedora Release Engineering <releng@fedoraproject.org> - 7.2.3-3
  - Rebuilt for https://fedoraproject.org/wiki/Fedora_42_Mass_Rebuild

Files

/usr/lib/.build-id
/usr/lib/.build-id/cd
/usr/lib/.build-id/cd/7b0110b482b0eaa7e7c450971a61a2f4ce903c
/usr/lib64/openmpi/bin/nwchem_binary_openmpi
/usr/lib64/openmpi/bin/nwchem_openmpi

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Fabrice Bellet, Sat Oct 31 03:37:13 2026