OpenMolcas-23.06-2.fc39 RPM for s390x

From Fedora 39 for s390x / 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(s390-64)
• 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 >= 2.37.9000-17
• libalaska.so()(64bit)
• libaverd.so()(64bit)
• libc.so.6()(64bit)
• libc.so.6(GLIBC_2.2)(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)
• 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)
• libgcc_s.so.1(GCC_4.0.0)(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.200()(64bit)
• liblast_energy.so()(64bit)
• liblevel.so()(64bit)
• liblocalisation.so()(64bit)
• libloprop.so()(64bit)
• libm.so.6()(64bit)
• libm.so.6(GLIBC_2.2)(64bit)
• libm.so.6(GLIBC_2.29)(64bit)
• libm.so.6(GLIBC_2.38)(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)
• libxcf03.so.12()(64bit)
• python3-pyparsing
• python3-setuptools
• 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

LGPLv2

Changelog

* Wed Jul 19 2023 Fedora Release Engineering <releng@fedoraproject.org> - 23.06-2
  - Rebuilt for https://fedoraproject.org/wiki/Fedora_39_Mass_Rebuild
* Thu Jun 15 2023 Susi Lehtola <jussilehtola@fedoraproject.org> - 23.06-1
  - Update to release 23.06.
* Wed Mar 15 2023 Susi Lehtola <jussilehtola@fedoraproject.org> - 23.02-1
  - Update to release 23.02.
* Wed Jan 18 2023 Fedora Release Engineering <releng@fedoraproject.org> - 22.10-3
  - Rebuilt for https://fedoraproject.org/wiki/Fedora_38_Mass_Rebuild
* Tue Oct 25 2022 Susi Lehtola <jussilehtola@fedoraproject.org> - 22.10-2
  - Bump for libxc rebuild.
* Sat Oct 15 2022 Susi Lehtola <jussilehtola@fedoraproject.org> - 22.10-1
  - Update to release 22.10.
* Wed Jul 20 2022 Fedora Release Engineering <releng@fedoraproject.org> - 22.06-3
  - Rebuilt for https://fedoraproject.org/wiki/Fedora_37_Mass_Rebuild
* Tue Jul 19 2022 Zbigniew Jędrzejewski-Szmek <zbyszek@in.waw.pl> - 22.06-2
  - Rebuilt for pyparsing-3.0.9
* Wed Jun 15 2022 Susi Lehtola <jussilehtola@fedoraproject.org> - 22.06-1
  - Update to release 22.06.
* Tue Feb 15 2022 Susi Lehtola <jussilehtola@fedoraproject.org> - 22.02-1
  - Update to release 22.02, including libxc support.
  - Also enabled HDF5 and CheMPS2 support.
* Wed Jan 19 2022 Fedora Release Engineering <releng@fedoraproject.org> - 21.10-2
  - Rebuilt for https://fedoraproject.org/wiki/Fedora_36_Mass_Rebuild
* Fri Nov 26 2021 Susi Lehtola <jussilehtola@fedoraproject.org> - 21.10-1
  - Update to release 21.10.
* Wed Jul 21 2021 Fedora Release Engineering <releng@fedoraproject.org> - 21.06-2
  - Rebuilt for https://fedoraproject.org/wiki/Fedora_35_Mass_Rebuild

Files

/etc/profile.d/OpenMolcas.csh
/etc/profile.d/OpenMolcas.sh
/usr/bin/pymolcas
/usr/lib/.build-id
/usr/lib/.build-id/00
/usr/lib/.build-id/00/ba833115b177b45a56c206c9590cbb653cd695
/usr/lib/.build-id/01
/usr/lib/.build-id/01/9f5c93d6a9597636c0311f7e741f28a268150a
/usr/lib/.build-id/05
/usr/lib/.build-id/05/a0df5385699331d88e3b60a2913f768b09a817
/usr/lib/.build-id/07
/usr/lib/.build-id/07/3d6b4b052bb101b69948cbd670efbbecc7ad6f
/usr/lib/.build-id/09
/usr/lib/.build-id/09/c52f04c931e84a5d472b0f007fa1a7a7955314
/usr/lib/.build-id/0a
/usr/lib/.build-id/0a/e8075b491a06894f6ec8b4fd332f82a479495a
/usr/lib/.build-id/0a/fb2ffe502b2b9dcb978ba919454596735257b3
/usr/lib/.build-id/0b
/usr/lib/.build-id/0b/c3586b441332b13305a2a8eb695579b5e6922c
/usr/lib/.build-id/10
/usr/lib/.build-id/10/143c01846e7d7d10aa8dfde8b48616dbe62eed
/usr/lib/.build-id/10/e9ebffecef324b5986eb4c26b2ccd3c069544a
/usr/lib/.build-id/12
/usr/lib/.build-id/12/b81f500fcddfd5af7bfe610658793bdd083450
/usr/lib/.build-id/12/d9e39d53f6ae01e352f12ca1917db0774085e5
/usr/lib/.build-id/13
/usr/lib/.build-id/13/c3aebe1800ab7cdf6f178a2787e10f1ace8f0d
/usr/lib/.build-id/1b
/usr/lib/.build-id/1b/871c79504d9573519cc85edc34a4a811990e5f
/usr/lib/.build-id/1d
/usr/lib/.build-id/1d/920fc220e39afc7780421b7dbe4031b8ea7d13
/usr/lib/.build-id/1e
/usr/lib/.build-id/1e/c85015ed729075d27145635c9b777c4c27bffe
/usr/lib/.build-id/21
/usr/lib/.build-id/21/f58618e7160da802b11da5bcdc356a8aef7262
/usr/lib/.build-id/22
/usr/lib/.build-id/22/b96fcf8ba232426252d3a79db54bf26267e1d1
/usr/lib/.build-id/24
/usr/lib/.build-id/24/762582dddaad4f070fcc357a3e12ee5fd3134b
/usr/lib/.build-id/2a
/usr/lib/.build-id/2a/2e6d445a8a44f41ba239a8b6e11c7778410fc8
/usr/lib/.build-id/36
/usr/lib/.build-id/36/f500610457eb2c56536b191b3eb0179079466a
/usr/lib/.build-id/37
/usr/lib/.build-id/37/2619e5a597ec98f128ebf4f716634d56430f5a
/usr/lib/.build-id/38
/usr/lib/.build-id/38/cf632d64de84c757b90af3de73dac6acf2e128
/usr/lib/.build-id/38/f7f84e5ad3bbae86f5b52e0d8cadb37b8cdfbc
/usr/lib/.build-id/3d
/usr/lib/.build-id/3d/14de7f51ce7fa7cdef7286557f740307cf818a
/usr/lib/.build-id/45
/usr/lib/.build-id/45/6aff0f7dd33ee72f182d2cc01867c35353a728
/usr/lib/.build-id/46
/usr/lib/.build-id/46/35999b7e5212764c2ea8d35eb510a821d5c173
/usr/lib/.build-id/4e
/usr/lib/.build-id/4e/be9a917ba91153cfdc4febb1dddb0b1054f904
/usr/lib/.build-id/53
/usr/lib/.build-id/53/c7cc1f25b5198c7ac276751c27af7bf873c144
/usr/lib/.build-id/55
/usr/lib/.build-id/55/754ca54063d2a3aa4b0d385d9675e85220f8b1
/usr/lib/.build-id/5a
/usr/lib/.build-id/5a/d48c77a1a284c9d6a805cf0ea20f66fc0fe31b
/usr/lib/.build-id/5c
/usr/lib/.build-id/5c/c6be5a7a9e23d420023bed80d15acde9c4943a
/usr/lib/.build-id/5d
/usr/lib/.build-id/5d/5dd2401d18687239d19f37cd720be68cd292db
/usr/lib/.build-id/5d/b61f656b21a22e5fb93b05996f1aeff3bd1252
/usr/lib/.build-id/5d/d6bd11181a79fd4163f68dab0c7e3f23b11fa4
/usr/lib/.build-id/5d/e1193ca3210399c83e4b5e872b0aa163443367
/usr/lib/.build-id/5f
/usr/lib/.build-id/5f/323429a67f3a443d4bbc01ee8ba5e5503a15b8
/usr/lib/.build-id/6d
/usr/lib/.build-id/6d/c92f16dc62cd6626044d789438e3c3b22d98e6
/usr/lib/.build-id/6e
/usr/lib/.build-id/6e/f21d9b9298480ad6b23f8b3e072b77815df146
/usr/lib/.build-id/70
/usr/lib/.build-id/70/01f70b5191348b8d76f58cf0d6e62eeb9b03b7
/usr/lib/.build-id/73
/usr/lib/.build-id/73/1eb1d97e2f8768532e7525cb74f8ffab0e5428
/usr/lib/.build-id/73/8dcd221b9f236992433986192dc48ec9883c91
/usr/lib/.build-id/73/a788c4d8bebadcafdf3f2c176b88b1cbc9d2ef
/usr/lib/.build-id/77
/usr/lib/.build-id/77/3ef65115778fb9daab565dde68369b7d8f6756
/usr/lib/.build-id/78
/usr/lib/.build-id/78/3f859536340939a5938c764e857ee206e53064
/usr/lib/.build-id/79
/usr/lib/.build-id/79/73d05945f42a46bc678d430e109074782de1ef
/usr/lib/.build-id/7b
/usr/lib/.build-id/7b/e0510ee616a8f64931b0704f3ef5cd0c613ee4
/usr/lib/.build-id/7d
/usr/lib/.build-id/7d/3cc9ad359a0d56d7c01a6d9b9c33e99e793941
/usr/lib/.build-id/82
/usr/lib/.build-id/82/c2081a2e42c5f11cab401733366d4c892f1f59
/usr/lib/.build-id/89
/usr/lib/.build-id/89/0780f4f416babcc6f20f7118e6df92106adfdd
/usr/lib/.build-id/8e
/usr/lib/.build-id/8e/a2747ab7a3dec9ad253f821f0cde5e4ea5de2e
/usr/lib/.build-id/90
/usr/lib/.build-id/90/ea7ccb16960a7689ef06dbe93317321d974b13
/usr/lib/.build-id/92
/usr/lib/.build-id/92/a5ca78e32421a6909d350e8caab5e9d763a0af
/usr/lib/.build-id/98
/usr/lib/.build-id/98/a3d060569e85af731fd31ef68624432081eb2f
/usr/lib/.build-id/98/a640d6d9c11664b01d55498fcbabfe520eac42
/usr/lib/.build-id/9b
/usr/lib/.build-id/9b/27dc83503f997890c1536affdec885b8f1d0b3
/usr/lib/.build-id/a0
/usr/lib/.build-id/a0/553acb72921c823c6018bb7d3e727eba776bd1
/usr/lib/.build-id/a2
/usr/lib/.build-id/a2/e4b269441c0df0f46996dff863e90f5d982ef2
/usr/lib/.build-id/a4
/usr/lib/.build-id/a4/18c963396b519af350e38b14f8b6a2a9ef5028
/usr/lib/.build-id/a6
/usr/lib/.build-id/a6/4b2bc099833aa87329d50308133fc57ddef33b
/usr/lib/.build-id/a8
/usr/lib/.build-id/a8/122ca4b2d5154652f8a2e7a10d4db64a77168b
/usr/lib/.build-id/a8/ce6c6afdc8e3d2f1d4b8b2eb9a8fe997b6bd0a
/usr/lib/.build-id/ab
/usr/lib/.build-id/ab/d50d35c630d3238fd7dd489ede4cac16726350
/usr/lib/.build-id/ac
/usr/lib/.build-id/ac/72add7acbef1d0d1e8e754f7091e88f3a8d43d
/usr/lib/.build-id/ad
/usr/lib/.build-id/ad/1a374ad19bdbeb6aa4dde45cde4afae65cff09
/usr/lib/.build-id/b0
/usr/lib/.build-id/b0/74ea6d05dc240992f7be44aa97925a6e69bf82
/usr/lib/.build-id/b1
/usr/lib/.build-id/b1/9a28456f203683814694833e60516bdf470110
/usr/lib/.build-id/b4
/usr/lib/.build-id/b4/889477c2cd2141ca0239142ab861a18f7eb53b
/usr/lib/.build-id/b5
/usr/lib/.build-id/b5/9953cba18dc2f0857eebafe7e840b1f7f3c07e
/usr/lib/.build-id/b9
/usr/lib/.build-id/b9/3e3e97f68d774d30ab0fbad55b6e7c65649ff8
/usr/lib/.build-id/ba
/usr/lib/.build-id/ba/752c64b06d78ca9d9eca7cbd61b6771e1c42a0
/usr/lib/.build-id/bd
/usr/lib/.build-id/bd/a4edab4589e79c7e780a8060576b823f7cf6e9
/usr/lib/.build-id/c0
/usr/lib/.build-id/c0/403ddfcb9718f8ff7b8b9d40136239f7a8cbdb
/usr/lib/.build-id/c2
/usr/lib/.build-id/c2/38f57fb81c5a330bb4563310855a9fb37fbbf5
/usr/lib/.build-id/c6
/usr/lib/.build-id/c6/1c22a09c2e55efa582be79cb6b59b8d6115606
/usr/lib/.build-id/c6/b2e01ecc169ccf916609cd074a2be397faf95f
/usr/lib/.build-id/c7
/usr/lib/.build-id/c7/8665bd6ab5b3506fb088a04c4a5fe03b610e83
/usr/lib/.build-id/cf
/usr/lib/.build-id/cf/d370caa9b469c3f5268629c0b2c912fc87b255
/usr/lib/.build-id/d0
/usr/lib/.build-id/d0/33b1ac92dd8f90b925e2dbe41494401787b985
/usr/lib/.build-id/d2
/usr/lib/.build-id/d2/16d174cbac4744a7665991118ff4f15a0f1b3a
/usr/lib/.build-id/d2/5da175542b03ffc87fdf74ee84f8c6a8dbd9ba
/usr/lib/.build-id/d8
/usr/lib/.build-id/d8/c5bac985ba0707c26c332fe8a56d6ee0553032
/usr/lib/.build-id/e0
/usr/lib/.build-id/e0/0e88700f0e17b5f1bec727e9d3459f6486feac
/usr/lib/.build-id/e2
/usr/lib/.build-id/e2/8dac2f56987b8e5d0f9432e68b555c8d2faaea
/usr/lib/.build-id/e8
/usr/lib/.build-id/e8/628b8cce1dc2e948bd881a164388dd3c8549c5
/usr/lib/.build-id/e9
/usr/lib/.build-id/e9/67a697ac281fa1d54beba24fdcc533ea979ba0
/usr/lib/.build-id/eb
/usr/lib/.build-id/eb/333900e5d735c6b1c1ffd4010153b9a5ebdc6e
/usr/lib/.build-id/f1
/usr/lib/.build-id/f1/d373ba986dc8072b1d1c9377c63baf62412ea4
/usr/lib/.build-id/f8
/usr/lib/.build-id/f8/d1fda83239e23379bc22cee4ba1033cd4a5262
/usr/lib/.build-id/f9
/usr/lib/.build-id/f9/cc1820e637ddb8810fea00173fe802ecc12910
/usr/lib/.build-id/fa
/usr/lib/.build-id/fa/1098ebe7eedebbd1034917e603a39e30dbc2cb
/usr/lib/.build-id/fa/b4957a5c6b0d8f37becdb116035a292a162f82
/usr/lib/.build-id/fc
/usr/lib/.build-id/fc/e9f1bb0ce605768b9846386b05cc67dad874fb
/usr/lib/.build-id/fd
/usr/lib/.build-id/fd/21266c9de87bd49b6d9d2e96df13914456baf3
/usr/lib/.build-id/fd/8debd8cb4438d1f066270e2cb229b0c6d9a28f
/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
/usr/lib64/OpenMolcas/basis_library/5-21G
/usr/lib64/OpenMolcas/basis_library/6-311Gpp
/usr/lib64/OpenMolcas/basis_library/6-31G
/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
/usr/lib64/OpenMolcas/basis_library/ANO-XS
/usr/lib64/OpenMolcas/basis_library/AUG-CC-PV5Z
/usr/lib64/OpenMolcas/basis_library/AUG-CC-PV6Z
/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
/usr/lib64/OpenMolcas/basis_library/DEF2-SVP
/usr/lib64/OpenMolcas/basis_library/DEF2-TZVP
/usr/lib64/OpenMolcas/basis_library/DEF2-TZVPP
/usr/lib64/OpenMolcas/basis_library/EMB-AIMP
/usr/lib64/OpenMolcas/basis_library/JGAUSS-DZP
/usr/lib64/OpenMolcas/basis_library/LANL2DZ
/usr/lib64/OpenMolcas/basis_library/LANL2DZ_NL
/usr/lib64/OpenMolcas/basis_library/MCP-AQZP
/usr/lib64/OpenMolcas/basis_library/MCP-ATZP
/usr/lib64/OpenMolcas/basis_library/MCP-DZP
/usr/lib64/OpenMolcas/basis_library/MCP-QZP
/usr/lib64/OpenMolcas/basis_library/MCP-TZP
/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
/usr/lib64/OpenMolcas/bin/genano.exe
/usr/lib64/OpenMolcas/bin/grid_it.exe
/usr/lib64/OpenMolcas/bin/guessorb.exe
/usr/lib64/OpenMolcas/bin/guga.exe
/usr/lib64/OpenMolcas/bin/gugaci.exe
/usr/lib64/OpenMolcas/bin/gugadrt.exe
/usr/lib64/OpenMolcas/bin/last_energy.exe
/usr/lib64/OpenMolcas/bin/level.exe
/usr/lib64/OpenMolcas/bin/localisation.exe
/usr/lib64/OpenMolcas/bin/loprop.exe
/usr/lib64/OpenMolcas/bin/mbpt2.exe
/usr/lib64/OpenMolcas/bin/mckinley.exe
/usr/lib64/OpenMolcas/bin/mclr.exe
/usr/lib64/OpenMolcas/bin/mcpdft.exe
/usr/lib64/OpenMolcas/bin/motra.exe
/usr/lib64/OpenMolcas/bin/mpprop.exe
/usr/lib64/OpenMolcas/bin/mrci.exe
/usr/lib64/OpenMolcas/bin/mula.exe
/usr/lib64/OpenMolcas/bin/numerical_gradient.exe
/usr/lib64/OpenMolcas/bin/parnell.exe
/usr/lib64/OpenMolcas/bin/poly_aniso.exe
/usr/lib64/OpenMolcas/bin/qmstat.exe
/usr/lib64/OpenMolcas/bin/quater.exe
/usr/lib64/OpenMolcas/bin/rasscf.exe
/usr/lib64/OpenMolcas/bin/rassi.exe
/usr/lib64/OpenMolcas/bin/rhodyn.exe
/usr/lib64/OpenMolcas/bin/rpa.exe
/usr/lib64/OpenMolcas/bin/scf.exe
/usr/lib64/OpenMolcas/bin/seward.exe
/usr/lib64/OpenMolcas/bin/single_aniso.exe
/usr/lib64/OpenMolcas/bin/slapaf.exe
/usr/lib64/OpenMolcas/bin/surfacehop.exe
/usr/lib64/OpenMolcas/bin/vibrot.exe
/usr/lib64/OpenMolcas/data
/usr/lib64/OpenMolcas/data/MolGUI.prgm
/usr/lib64/OpenMolcas/data/abdata
/usr/lib64/OpenMolcas/data/alaska.prgm
/usr/lib64/OpenMolcas/data/averd.prgm
/usr/lib64/OpenMolcas/data/banner.txt
/usr/lib64/OpenMolcas/data/caspt2.prgm
/usr/lib64/OpenMolcas/data/casvb.prgm
/usr/lib64/OpenMolcas/data/ccsdt.prgm
/usr/lib64/OpenMolcas/data/chcc.prgm
/usr/lib64/OpenMolcas/data/check.prgm
/usr/lib64/OpenMolcas/data/cht3.prgm
/usr/lib64/OpenMolcas/data/cpf.prgm
/usr/lib64/OpenMolcas/data/dmrgscf.prgm
/usr/lib64/OpenMolcas/data/dynamix.prgm
/usr/lib64/OpenMolcas/data/espf.prgm
/usr/lib64/OpenMolcas/data/expbas.prgm
/usr/lib64/OpenMolcas/data/extf.prgm
/usr/lib64/OpenMolcas/data/false.prgm
/usr/lib64/OpenMolcas/data/ffpt.prgm
/usr/lib64/OpenMolcas/data/functionals.txt
/usr/lib64/OpenMolcas/data/gateway.prgm
/usr/lib64/OpenMolcas/data/genano.prgm
/usr/lib64/OpenMolcas/data/global.prgm
/usr/lib64/OpenMolcas/data/grid_it.prgm
/usr/lib64/OpenMolcas/data/guessorb.prgm
/usr/lib64/OpenMolcas/data/guga.prgm
/usr/lib64/OpenMolcas/data/gugaci.prgm
/usr/lib64/OpenMolcas/data/gugadrt.prgm
/usr/lib64/OpenMolcas/data/info.txt
/usr/lib64/OpenMolcas/data/inporb_files.prgm
/usr/lib64/OpenMolcas/data/inputs.tpl
/usr/lib64/OpenMolcas/data/isotope_data.txt
/usr/lib64/OpenMolcas/data/keyword.db
/usr/lib64/OpenMolcas/data/keyword.xml
/usr/lib64/OpenMolcas/data/landing.txt
/usr/lib64/OpenMolcas/data/last_energy.prgm
/usr/lib64/OpenMolcas/data/level.prgm
/usr/lib64/OpenMolcas/data/localisation.prgm
/usr/lib64/OpenMolcas/data/loprop.prgm
/usr/lib64/OpenMolcas/data/mbpt2.prgm
/usr/lib64/OpenMolcas/data/mckinley.prgm
/usr/lib64/OpenMolcas/data/mclr.prgm
/usr/lib64/OpenMolcas/data/mcpdft.prgm
/usr/lib64/OpenMolcas/data/modalias.txt
/usr/lib64/OpenMolcas/data/motra.prgm
/usr/lib64/OpenMolcas/data/mpprop.prgm
/usr/lib64/OpenMolcas/data/mpssi.prgm
/usr/lib64/OpenMolcas/data/mrci.prgm
/usr/lib64/OpenMolcas/data/mula.prgm
/usr/lib64/OpenMolcas/data/nevpt2.prgm
/usr/lib64/OpenMolcas/data/numerical_gradient.prgm
/usr/lib64/OpenMolcas/data/poly_aniso.prgm
/usr/lib64/OpenMolcas/data/qmstat.prgm
/usr/lib64/OpenMolcas/data/quater.prgm
/usr/lib64/OpenMolcas/data/rasscf.prgm
/usr/lib64/OpenMolcas/data/rassi.prgm
/usr/lib64/OpenMolcas/data/rcodes.txt
/usr/lib64/OpenMolcas/data/rhodyn.prgm
/usr/lib64/OpenMolcas/data/rpa.prgm
/usr/lib64/OpenMolcas/data/rysrw
/usr/lib64/OpenMolcas/data/scf.prgm
/usr/lib64/OpenMolcas/data/seward.prgm
/usr/lib64/OpenMolcas/data/single_aniso.prgm
/usr/lib64/OpenMolcas/data/slapaf.prgm
/usr/lib64/OpenMolcas/data/surfacehop.prgm
/usr/lib64/OpenMolcas/data/symmetrize.prgm
/usr/lib64/OpenMolcas/data/vibrot.prgm
/usr/lib64/OpenMolcas/data/wfa.prgm
/usr/lib64/OpenMolcas/doc
/usr/lib64/OpenMolcas/lib
/usr/lib64/OpenMolcas/lib/libalaska.so
/usr/lib64/OpenMolcas/lib/libaverd.so
/usr/lib64/OpenMolcas/lib/libcaspt2.so
/usr/lib64/OpenMolcas/lib/libcasvb.so
/usr/lib64/OpenMolcas/lib/libccsdt.so
/usr/lib64/OpenMolcas/lib/libchcc.so
/usr/lib64/OpenMolcas/lib/libcht3.so
/usr/lib64/OpenMolcas/lib/libcpf.so
/usr/lib64/OpenMolcas/lib/libdynamix.so
/usr/lib64/OpenMolcas/lib/libexpbas.so
/usr/lib64/OpenMolcas/lib/libextf.so
/usr/lib64/OpenMolcas/lib/libfalse.so
/usr/lib64/OpenMolcas/lib/libffpt.so
/usr/lib64/OpenMolcas/lib/libgateway.so
/usr/lib64/OpenMolcas/lib/libgenano.so
/usr/lib64/OpenMolcas/lib/libgrid_it.so
/usr/lib64/OpenMolcas/lib/libguessorb.so
/usr/lib64/OpenMolcas/lib/libguga.so
/usr/lib64/OpenMolcas/lib/libgugaci.so
/usr/lib64/OpenMolcas/lib/libgugadrt.so
/usr/lib64/OpenMolcas/lib/liblast_energy.so
/usr/lib64/OpenMolcas/lib/liblevel.so
/usr/lib64/OpenMolcas/lib/liblocalisation.so
/usr/lib64/OpenMolcas/lib/libloprop.so
/usr/lib64/OpenMolcas/lib/libmbpt2.so
/usr/lib64/OpenMolcas/lib/libmckinley.so
/usr/lib64/OpenMolcas/lib/libmclr.so
/usr/lib64/OpenMolcas/lib/libmcpdft.so
/usr/lib64/OpenMolcas/lib/libmolcas.so
/usr/lib64/OpenMolcas/lib/libmotra.so
/usr/lib64/OpenMolcas/lib/libmpprop.so
/usr/lib64/OpenMolcas/lib/libmrci.so
/usr/lib64/OpenMolcas/lib/libmula.so
/usr/lib64/OpenMolcas/lib/libnumerical_gradient.so
/usr/lib64/OpenMolcas/lib/libpoly_aniso.so
/usr/lib64/OpenMolcas/lib/libqmstat.so
/usr/lib64/OpenMolcas/lib/libquater.so
/usr/lib64/OpenMolcas/lib/librasscf.so
/usr/lib64/OpenMolcas/lib/librassi.so
/usr/lib64/OpenMolcas/lib/librhodyn.so
/usr/lib64/OpenMolcas/lib/librpa.so
/usr/lib64/OpenMolcas/lib/libscf.so
/usr/lib64/OpenMolcas/lib/libseward.so
/usr/lib64/OpenMolcas/lib/libsingle_aniso.so
/usr/lib64/OpenMolcas/lib/libslapaf.so
/usr/lib64/OpenMolcas/lib/libsurfacehop.so
/usr/lib64/OpenMolcas/lib/libvibrot.so
/usr/lib64/OpenMolcas/molcas.rte
/usr/lib64/OpenMolcas/pymolcas
/usr/lib64/OpenMolcas/python
/usr/lib64/OpenMolcas/python/abstract_flow.py
/usr/lib64/OpenMolcas/python/check_test.py
/usr/lib64/OpenMolcas/python/emil_grammar.py
/usr/lib64/OpenMolcas/python/emil_parse.py
/usr/lib64/OpenMolcas/python/export.py
/usr/lib64/OpenMolcas/python/imports.py
/usr/lib64/OpenMolcas/python/molcas_aux.py
/usr/lib64/OpenMolcas/python/molcas_wrapper.py
/usr/lib64/OpenMolcas/python/pack.py
/usr/lib64/OpenMolcas/python/python_parse.py
/usr/lib64/OpenMolcas/python/simpleeval.py
/usr/lib64/OpenMolcas/python/tee.py
/usr/lib64/OpenMolcas/python/validate.py
/usr/lib64/OpenMolcas/sbin
/usr/lib64/OpenMolcas/sbin/help_basis
/usr/lib64/OpenMolcas/sbin/help_doc
/usr/lib64/OpenMolcas/sbin/help_func
/usr/lib64/OpenMolcas/sbin/setup
/usr/lib64/OpenMolcas/sbin/version
/usr/share/doc/OpenMolcas
/usr/share/doc/OpenMolcas/CONTRIBUTORS.md
/usr/share/licenses/OpenMolcas
/usr/share/licenses/OpenMolcas/LICENSE

Generated by rpm2html 1.8.1

Fabrice Bellet, Sun Mar 9 17:16:57 2025