openmolcas-data (25.02-2)
Details
Core information at a glance
- Distribution
- kali
- Origin
- kali-last-snapshot
- Repository
- https://http.kali.org/kali
- Codename
- kali-last-snapshot
- Component
- main
- Source
- openmolcas
- Architecture
- i386
- Section
- science
- Priority
- optional
- Maintainer
- Debichem Team <[email protected]>
Size & integrity
Byte sizes and integrity verification
- Installed size
- 89 kB
- Size expected
- 14.1 MB
- Size actual
- 14.1 MB
- Size match
Dependencies
Required package dependencies
- None
Suggested packages
Recommended additional packages
- None
Description
Quantum chemistry software package (data files)
Tags
Package classification tags
None
Checksums
Hash values and integrity verification status
| Type | Actual | Match |
|---|---|---|
| MD5 | 9324edb9…04695289 | |
| SHA-1 | bdc958e0…c4e020cf | |
| SHA-256 | 5faedaed…a95cf269 | |
| SHA-512 | b525cc21…532bc80f |
Contents
Files and directories included
. usr usr/share usr/share/doc usr/share/doc/openmolcas-data usr/share/doc/openmolcas-data/changelog.Debian.gz usr/share/doc/openmolcas-data/copyright usr/share/openmolcas usr/share/openmolcas/.molcashome usr/share/openmolcas/.molcasversion usr/share/openmolcas/CONTRIBUTORS.md usr/share/openmolcas/LICENSE usr/share/openmolcas/basis_library usr/share/openmolcas/basis_library/3-21G usr/share/openmolcas/basis_library/4-31G usr/share/openmolcas/basis_library/5-21G usr/share/openmolcas/basis_library/6-311Gpp usr/share/openmolcas/basis_library/6-31G usr/share/openmolcas/basis_library/6-31Gpp usr/share/openmolcas/basis_library/AHLRICHS_VDZ usr/share/openmolcas/basis_library/AHLRICHS_VTZ usr/share/openmolcas/basis_library/AIMP.README usr/share/openmolcas/basis_library/ANO-DK3 usr/share/openmolcas/basis_library/ANO-L usr/share/openmolcas/basis_library/ANO-ORCA usr/share/openmolcas/basis_library/ANO-R usr/share/openmolcas/basis_library/ANO-RCC usr/share/openmolcas/basis_library/ANO-RCC.README usr/share/openmolcas/basis_library/ANO-S usr/share/openmolcas/basis_library/ANO-XS usr/share/openmolcas/basis_library/AUG-CC-PV5Z usr/share/openmolcas/basis_library/AUG-CC-PV6Z usr/share/openmolcas/basis_library/AUG-CC-PVDZ usr/share/openmolcas/basis_library/AUG-CC-PVQZ usr/share/openmolcas/basis_library/AUG-CC-PVTZ usr/share/openmolcas/basis_library/AUG-PC-0 usr/share/openmolcas/basis_library/AUG-PC-1 usr/share/openmolcas/basis_library/AUG-PC-2 usr/share/openmolcas/basis_library/AUG-PC-3 usr/share/openmolcas/basis_library/AUG-PC-4 usr/share/openmolcas/basis_library/CC-PV5Z usr/share/openmolcas/basis_library/CC-PV5Z-DK usr/share/openmolcas/basis_library/CC-PVDZ usr/share/openmolcas/basis_library/CC-PVDZ-DK usr/share/openmolcas/basis_library/CC-PVQZ usr/share/openmolcas/basis_library/CC-PVQZ-DK usr/share/openmolcas/basis_library/CC-PVTZ usr/share/openmolcas/basis_library/CC-PVTZ-DK usr/share/openmolcas/basis_library/CC-PWCV5Z-DK usr/share/openmolcas/basis_library/CC-PWCVQZ-DK usr/share/openmolcas/basis_library/CC-PWCVTZ-DK usr/share/openmolcas/basis_library/CG-AIMP usr/share/openmolcas/basis_library/DEF-SV-P usr/share/openmolcas/basis_library/DEF-SVP usr/share/openmolcas/basis_library/DEF-TZVP usr/share/openmolcas/basis_library/DEF2-SVP usr/share/openmolcas/basis_library/DEF2-TZVP usr/share/openmolcas/basis_library/DEF2-TZVPP usr/share/openmolcas/basis_library/EMB-AIMP usr/share/openmolcas/basis_library/JGAUSS-DZP usr/share/openmolcas/basis_library/LANL2DZ usr/share/openmolcas/basis_library/LANL2DZ_NL usr/share/openmolcas/basis_library/MCP-AQZP usr/share/openmolcas/basis_library/MCP-ATZP usr/share/openmolcas/basis_library/MCP-DZP usr/share/openmolcas/basis_library/MCP-QZP usr/share/openmolcas/basis_library/MCP-TZP usr/share/openmolcas/basis_library/MUONIC usr/share/openmolcas/basis_library/NP-AIMP usr/share/openmolcas/basis_library/NR-AIMP usr/share/openmolcas/basis_library/PC-0 usr/share/openmolcas/basis_library/PC-1 usr/share/openmolcas/basis_library/PC-2 usr/share/openmolcas/basis_library/PC-3 usr/share/openmolcas/basis_library/PC-4 usr/share/openmolcas/basis_library/QRPLIB usr/share/openmolcas/basis_library/RAF-R usr/share/openmolcas/basis_library/RYDBERG usr/share/openmolcas/basis_library/SADLEJ_PVTZ usr/share/openmolcas/basis_library/SARC2-QZVP-DKH2 usr/share/openmolcas/basis_library/STO-3G usr/share/openmolcas/basis_library/STUTTGART usr/share/openmolcas/basis_library/STUTTGART_NL usr/share/openmolcas/basis_library/basis.tbl usr/share/openmolcas/basis_library/basistype.tbl usr/share/openmolcas/basis_library/c_Basis usr/share/openmolcas/basis_library/c_Basis/DEF-SV-P usr/share/openmolcas/basis_library/c_Basis/DEF-SVP usr/share/openmolcas/basis_library/c_Basis/DEF-TZVP usr/share/openmolcas/basis_library/c_Basis/basis.tbl usr/share/openmolcas/basis_library/c_Basis/basistype.tbl usr/share/openmolcas/basis_library/c_Basis/trans.tbl usr/share/openmolcas/basis_library/j_Basis usr/share/openmolcas/basis_library/j_Basis/DEF-SV-P usr/share/openmolcas/basis_library/j_Basis/DEF-SVP usr/share/openmolcas/basis_library/j_Basis/DEF-TZVP usr/share/openmolcas/basis_library/j_Basis/basis.tbl usr/share/openmolcas/basis_library/j_Basis/basistype.tbl usr/share/openmolcas/basis_library/j_Basis/trans.tbl usr/share/openmolcas/basis_library/jk_Basis usr/share/openmolcas/basis_library/jk_Basis/CC-PVTZ usr/share/openmolcas/basis_library/jk_Basis/DEF-SV-P usr/share/openmolcas/basis_library/jk_Basis/DEF-SVP usr/share/openmolcas/basis_library/jk_Basis/basis.tbl usr/share/openmolcas/basis_library/jk_Basis/basistype.tbl usr/share/openmolcas/basis_library/jk_Basis/trans.tbl usr/share/openmolcas/basis_library/trans.tbl usr/share/openmolcas/data usr/share/openmolcas/data/MolGUI.prgm usr/share/openmolcas/data/abdata usr/share/openmolcas/data/alaska.prgm usr/share/openmolcas/data/averd.prgm usr/share/openmolcas/data/banner.txt usr/share/openmolcas/data/caspt2.prgm usr/share/openmolcas/data/casvb.prgm usr/share/openmolcas/data/ccsdt.prgm usr/share/openmolcas/data/chcc.prgm usr/share/openmolcas/data/check.prgm usr/share/openmolcas/data/cht3.prgm usr/share/openmolcas/data/cpf.prgm usr/share/openmolcas/data/dmrgscf.prgm usr/share/openmolcas/data/dynamix.prgm usr/share/openmolcas/data/espf.prgm usr/share/openmolcas/data/expbas.prgm usr/share/openmolcas/data/extf.prgm usr/share/openmolcas/data/false.prgm usr/share/openmolcas/data/ffpt.prgm usr/share/openmolcas/data/functionals.txt usr/share/openmolcas/data/gateway.prgm usr/share/openmolcas/data/genano.prgm usr/share/openmolcas/data/global.prgm usr/share/openmolcas/data/grid_it.prgm usr/share/openmolcas/data/guessorb.prgm usr/share/openmolcas/data/guga.prgm usr/share/openmolcas/data/gugaci.prgm usr/share/openmolcas/data/gugadrt.prgm usr/share/openmolcas/data/inporb_files.prgm usr/share/openmolcas/data/inputs.tpl usr/share/openmolcas/data/isotope_data.txt usr/share/openmolcas/data/keyword.db usr/share/openmolcas/data/keyword.xml usr/share/openmolcas/data/landing.txt usr/share/openmolcas/data/last_energy.prgm usr/share/openmolcas/data/level.prgm usr/share/openmolcas/data/localisation.prgm usr/share/openmolcas/data/loprop.prgm usr/share/openmolcas/data/mbpt2.prgm usr/share/openmolcas/data/mckinley.prgm usr/share/openmolcas/data/mclr.prgm usr/share/openmolcas/data/mcpdft.prgm usr/share/openmolcas/data/modalias.txt usr/share/openmolcas/data/motra.prgm usr/share/openmolcas/data/mpprop.prgm usr/share/openmolcas/data/mpssi.prgm usr/share/openmolcas/data/mrci.prgm usr/share/openmolcas/data/mula.prgm usr/share/openmolcas/data/nevpt2.prgm usr/share/openmolcas/data/numerical_gradient.prgm usr/share/openmolcas/data/poly_aniso.prgm usr/share/openmolcas/data/qmstat.prgm usr/share/openmolcas/data/quater.prgm usr/share/openmolcas/data/rasscf.prgm usr/share/openmolcas/data/rassi.prgm usr/share/openmolcas/data/rcodes.txt usr/share/openmolcas/data/rhodyn.prgm usr/share/openmolcas/data/rpa.prgm usr/share/openmolcas/data/rysrw usr/share/openmolcas/data/scf.prgm usr/share/openmolcas/data/seward.prgm usr/share/openmolcas/data/single_aniso.prgm usr/share/openmolcas/data/slapaf.prgm usr/share/openmolcas/data/surfacehop.prgm usr/share/openmolcas/data/symmetrize.prgm usr/share/openmolcas/data/vibrot.prgm usr/share/openmolcas/data/wfa.prgm usr/share/openmolcas/molcas.rte usr/share/openmolcas/test usr/share/openmolcas/test/additional usr/share/openmolcas/test/additional/.all usr/share/openmolcas/test/additional/.critical usr/share/openmolcas/test/additional/.default usr/share/openmolcas/test/additional/.official usr/share/openmolcas/test/additional/100.input usr/share/openmolcas/test/additional/101.input usr/share/openmolcas/test/additional/102.input usr/share/openmolcas/test/additional/103.input usr/share/openmolcas/test/additional/104.input usr/share/openmolcas/test/additional/105.input usr/share/openmolcas/test/additional/106.input usr/share/openmolcas/test/additional/107.input usr/share/openmolcas/test/additional/108.input 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