psi4-1.3.2-19.fc38 in Fedora 38
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Package Info (Data from x86_64 build)
🠗 Changelog
🠗 Dependencies
🠗 Provides
🠗 Files
Changelog
| Date | Author | Change |
|---|---|---|
| 2023-05-02 | Susi Lehtola <jussilehtola at fedoraproject dot org> - 1:1.3.2-19 | - Address deprecated np.int (BZ #2192326). |
| 2023-01-20 | Fedora Release Engineering <releng at fedoraproject dot org> - 1:1.3.2-18 | - Rebuilt for https://fedoraproject.org/wiki/Fedora_38_Mass_Rebuild |
| 2022-11-02 | Susi Lehtola <jussilehtola at fedoraproject dot org> - 1:1.3.2-17 | - Fix build issue on rawhide. |
| 2022-10-27 | Mamoru TASAKA <mtasaka at fedoraproject dot org> - 1:1.3.2-16 | - Rebuild for new libxc |
| 2022-07-22 | Fedora Release Engineering <releng at fedoraproject dot org> - 1:1.3.2-15 | - Rebuilt for https://fedoraproject.org/wiki/Fedora_37_Mass_Rebuild |
| 2022-01-21 | Fedora Release Engineering <releng at fedoraproject dot org> - 1:1.3.2-14 | - Rebuilt for https://fedoraproject.org/wiki/Fedora_36_Mass_Rebuild |
| 2021-07-23 | Fedora Release Engineering <releng at fedoraproject dot org> - 1:1.3.2-13 | - Rebuilt for https://fedoraproject.org/wiki/Fedora_35_Mass_Rebuild |
| 2021-07-13 | Björn Esser <besser82 at fedoraproject dot org> - 1:1.3.2-12 | - Add a patch for native support of FlexiBLAS - Explicitly turn ENABLE_AUTO_LAPACK on |
| 2021-06-04 | Python Maint <python dash maint at redhat dot com> - 1:1.3.2-11 | - Rebuilt for Python 3.10 |
Dependencies
- flexiblas-netlib
- glibc
- libgcc
- libgomp
- libstdc++
- libxc
- psi4-data = 1.3.2-19.fc38
- python2.7 = 3.11
- python3 = 3.11
- python3-numpy
Provides
- psi4
- psi4(x86-64)
Files
- usr/
- bin/
- psi4
- lib/
- .build-id/
- b0/
- 5e46f1db9fb8133e1c92d420da9767fc048c51
- b0/
- .build-id/
- lib64/
- python3.11/
- site-packages/
- psi4/
- __init__.py
- __pycache__/
- __init__.cpython-311.opt-1.pyc
- __init__.cpython-311.pyc
- extras.cpython-311.opt-1.pyc
- extras.cpython-311.pyc
- header.cpython-311.opt-1.pyc
- header.cpython-311.pyc
- metadata.cpython-311.opt-1.pyc
- metadata.cpython-311.pyc
- core.so
- driver/
- __init__.py
- __pycache__/
- __init__.cpython-311.opt-1.pyc
- __init__.cpython-311.pyc
- aliases.cpython-311.opt-1.pyc
- aliases.cpython-311.pyc
- dependency_check.cpython-311.opt-1.pyc
- dependency_check.cpython-311.pyc
- diatomic.cpython-311.opt-1.pyc
- diatomic.cpython-311.pyc
- driver.cpython-311.opt-1.pyc
- driver.cpython-311.pyc
- driver_cbs.cpython-311.opt-1.pyc
- driver_cbs.cpython-311.pyc
- driver_findif.cpython-311.opt-1.pyc
- driver_findif.cpython-311.pyc
- driver_nbody.cpython-311.opt-1.pyc
- driver_nbody.cpython-311.pyc
- driver_nbody_helper.cpython-311.opt-1.pyc
- driver_nbody_helper.cpython-311.pyc
- driver_util.cpython-311.opt-1.pyc
- driver_util.cpython-311.pyc
- endorsed_plugins.cpython-311.opt-1.pyc
- endorsed_plugins.cpython-311.pyc
- frac.cpython-311.opt-1.pyc
- frac.cpython-311.pyc
- gaussian_n.cpython-311.opt-1.pyc
- gaussian_n.cpython-311.pyc
- inputparser.cpython-311.opt-1.pyc
- inputparser.cpython-311.pyc
- json_wrapper.cpython-311.opt-1.pyc
- json_wrapper.cpython-311.pyc
- molutil.cpython-311.opt-1.pyc
- molutil.cpython-311.pyc
- plugin.cpython-311.opt-1.pyc
- plugin.cpython-311.pyc
- psifiles.cpython-311.opt-1.pyc
- psifiles.cpython-311.pyc
- qmmm.cpython-311.opt-1.pyc
- qmmm.cpython-311.pyc
- wrapper_autofrag.cpython-311.opt-1.pyc
- wrapper_autofrag.cpython-311.pyc
- wrapper_database.cpython-311.opt-1.pyc
- wrapper_database.cpython-311.pyc
- aliases.py
- dependency_check.py
- diatomic.py
- driver.py
- driver_cbs.py
- driver_findif.py
- driver_nbody.py
- driver_nbody_helper.py
- driver_util.py
- endorsed_plugins.py
- frac.py
- gaussian_n.py
- inputparser.py
- json_wrapper.py
- molutil.py
- p4util/
- __init__.py
- __pycache__/
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- fcidump.cpython-311.pyc
- inpsight.cpython-311.opt-1.pyc
- inpsight.cpython-311.pyc
- numpy_helper.cpython-311.opt-1.pyc
- numpy_helper.cpython-311.pyc
- optproc.cpython-311.opt-1.pyc
- optproc.cpython-311.pyc
- p4regex.cpython-311.opt-1.pyc
- p4regex.cpython-311.pyc
- procutil.cpython-311.opt-1.pyc
- procutil.cpython-311.pyc
- python_helpers.cpython-311.opt-1.pyc
- python_helpers.cpython-311.pyc
- solvers.cpython-311.opt-1.pyc
- solvers.cpython-311.pyc
- text.cpython-311.opt-1.pyc
- text.cpython-311.pyc
- util.cpython-311.opt-1.pyc
- util.cpython-311.pyc
- exceptions.py
- fcidump.py
- inpsight.py
- numpy_helper.py
- optproc.py
- p4regex.py
- procutil.py
- python_helpers.py
- solvers.py
- text.py
- util.py
- plugin.py
- procrouting/
- __init__.py
- __pycache__/
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- __init__.cpython-311.pyc
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- interface_cfour.cpython-311.pyc
- proc.cpython-311.opt-1.pyc
- proc.cpython-311.pyc
- proc_table.cpython-311.opt-1.pyc
- proc_table.cpython-311.pyc
- proc_util.cpython-311.opt-1.pyc
- proc_util.cpython-311.pyc
- roa.cpython-311.opt-1.pyc
- roa.cpython-311.pyc
- wrappers_cfour.cpython-311.opt-1.pyc
- wrappers_cfour.cpython-311.pyc
- dft/
- __init__.py
- __pycache__/
- __init__.cpython-311.opt-1.pyc
- __init__.cpython-311.pyc
- dft_builder.cpython-311.opt-1.pyc
- dft_builder.cpython-311.pyc
- dh_functionals.cpython-311.opt-1.pyc
- dh_functionals.cpython-311.pyc
- gga_functionals.cpython-311.opt-1.pyc
- gga_functionals.cpython-311.pyc
- hyb_functionals.cpython-311.opt-1.pyc
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- libxc_functionals.cpython-311.opt-1.pyc
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- mgga_functionals.cpython-311.pyc
- superfunctionals.cpython-311.opt-1.pyc
- superfunctionals.cpython-311.pyc
- dft_builder.py
- dh_functionals.py
- gga_functionals.py
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- mcscf/
- __init__.py
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- augmented_hessian.cpython-311.opt-1.pyc
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- mcscf_solver.cpython-311.pyc
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- proc.py
- proc_table.py
- proc_util.py
- response/
- __init__.py
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- __init__.cpython-311.pyc
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- scf_products.py
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- roa.py
- sapt/
- __init__.py
- __pycache__/
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- __init__.cpython-311.pyc
- fisapt_proc.cpython-311.opt-1.pyc
- fisapt_proc.cpython-311.pyc
- sapt_jk_terms.cpython-311.opt-1.pyc
- sapt_jk_terms.cpython-311.pyc
- sapt_mp2_terms.cpython-311.opt-1.pyc
- sapt_mp2_terms.cpython-311.pyc
- sapt_proc.cpython-311.opt-1.pyc
- sapt_proc.cpython-311.pyc
- sapt_sf_terms.cpython-311.opt-1.pyc
- sapt_sf_terms.cpython-311.pyc
- sapt_util.cpython-311.opt-1.pyc
- sapt_util.cpython-311.pyc
- fisapt_proc.py
- sapt_jk_terms.py
- sapt_mp2_terms.py
- sapt_proc.py
- sapt_sf_terms.py
- sapt_util.py
- scf_proc/
- __init__.py
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- scf_iterator.cpython-311.opt-1.pyc
- scf_iterator.cpython-311.pyc
- efp.py
- scf_iterator.py
- wrappers_cfour.py
- psifiles.py
- qcdb/
- __init__.py
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- basislist.cpython-311.pyc
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- basislistother.cpython-311.opt-1.pyc
- basislistother.cpython-311.pyc
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- cfour.cpython-311.opt-1.pyc
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- datastructures.cpython-311.opt-1.pyc
- datastructures.cpython-311.pyc
- dbproc.cpython-311.opt-1.pyc
- dbproc.cpython-311.pyc
- dbwrap.cpython-311.opt-1.pyc
- dbwrap.cpython-311.pyc
- exceptions.cpython-311.opt-1.pyc
- exceptions.cpython-311.pyc
- gradparse.cpython-311.opt-1.pyc
- gradparse.cpython-311.pyc
- hessparse.cpython-311.opt-1.pyc
- hessparse.cpython-311.pyc
- interface_gcp.cpython-311.opt-1.pyc
- interface_gcp.cpython-311.pyc
- jajo.cpython-311.opt-1.pyc
- jajo.cpython-311.pyc
- libmintsbasisset.cpython-311.opt-1.pyc
- libmintsbasisset.cpython-311.pyc
- libmintsbasissetparser.cpython-311.opt-1.pyc
- libmintsbasissetparser.cpython-311.pyc
- libmintscoordentry.cpython-311.opt-1.pyc
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- libmintsmolecule.cpython-311.opt-1.pyc
- libmintsmolecule.cpython-311.pyc
- libmintspointgrp.cpython-311.opt-1.pyc
- libmintspointgrp.cpython-311.pyc
- modelchems.cpython-311.opt-1.pyc
- modelchems.cpython-311.pyc
- molecule.cpython-311.opt-1.pyc
- molecule.cpython-311.pyc
- molpro.cpython-311.opt-1.pyc
- molpro.cpython-311.pyc
- molpro2.cpython-311.opt-1.pyc
- molpro2.cpython-311.pyc
- molpro_basissets.cpython-311.opt-1.pyc
- molpro_basissets.cpython-311.pyc
- mpl.cpython-311.opt-1.pyc
- mpl.cpython-311.pyc
- options.cpython-311.opt-1.pyc
- options.cpython-311.pyc
- orca.cpython-311.opt-1.pyc
- orca.cpython-311.pyc
- orient.cpython-311.opt-1.pyc
- orient.cpython-311.pyc
- parker.cpython-311.opt-1.pyc
- parker.cpython-311.pyc
- pdict.cpython-311.opt-1.pyc
- pdict.cpython-311.pyc
- psiutil.cpython-311.opt-1.pyc
- psiutil.cpython-311.pyc
- psivardefs.cpython-311.opt-1.pyc
- psivardefs.cpython-311.pyc
- psivarrosetta.cpython-311.opt-1.pyc
- psivarrosetta.cpython-311.pyc
- qcformat.cpython-311.opt-1.pyc
- qcformat.cpython-311.pyc
- qchem.cpython-311.opt-1.pyc
- qchem.cpython-311.pyc
- qcprog_psi4.cpython-311.opt-1.pyc
- qcprog_psi4.cpython-311.pyc
- subsetgenerator.cpython-311.opt-1.pyc
- subsetgenerator.cpython-311.pyc
- textables.cpython-311.opt-1.pyc
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- vib.cpython-311.opt-1.pyc
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- basislist.py
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- cfour.py
- datastructures.py
- dbproc.py
- dbwrap.py
- exceptions.py
- gradparse.py
- hessparse.py
- interface_gcp.py
- intf_dftd3/
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- worker.cpython-311.pyc
- dashparam.py
- runner.py
- worker.py
- jajo.py
- libmintsbasisset.py
- libmintsbasissetparser.py
- libmintscoordentry.py
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- modelchems.py
- molecule.py
- molpro.py
- molpro2.py
- molpro_basissets.py
- mpl.py
- options.py
- orca.py
- orient.py
- parker.py
- pdict.py
- psiutil.py
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- __pycache__/
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- np_rand3drot.py
- regex.py
- scipy_hungarian.py
- vecutil.py
- vib.py
- qmmm.py
- util/
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- metadata.py
- tests/
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- test_psi4.cpython-311.pyc
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- test_tdscf_excitations.cpython-311.opt-1.pyc
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- test_tdscf_products.cpython-311.opt-1.pyc
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- test_vector.cpython-311.opt-1.pyc
- test_vector.cpython-311.pyc
- test_vibanalysis.cpython-311.opt-1.pyc
- test_vibanalysis.cpython-311.pyc
- utils.cpython-311.opt-1.pyc
- utils.cpython-311.pyc
- addons.py
- conftest.py
- test_addons.py
- test_dft_benchmarks.py
- test_dftd3.py
- test_fcidump_energy.py
- test_matrix.py
- test_molecule_to_string.py
- test_psi4.py
- test_qcvars.py
- test_solvers.py
- test_tdscf_excitations.py
- test_tdscf_products.py
- test_vector.py
- test_vibanalysis.py
- utils.py
- __pycache__/
- psi4/
- site-packages/
- python3.11/
- share/
- doc/
- psi4/
- README.md
- psi4/
- licenses/
- psi4/
- COPYING
- COPYING.LESSER
- psi4/
- doc/
- bin/
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