python3-pyscf-2.2.1-1.fc38 in Fedora 38
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Package Info (Data from x86_64 build)
🠗 Changelog
🠗 Dependencies
🠗 Provides
🠗 Files
Changelog
| Date | Author | Change |
|---|---|---|
| 2023-04-03 | Susi Lehtola <jussilehtola at fedoraproject dot org> - 2.2.1-1 | - Update to 2.2.1. |
| 2023-03-16 | Susi Lehtola <jussilehtola at fedoraproject dot org> - 2.2.0-1 | - Update to 2.2.0. |
| 2023-01-20 | Fedora Release Engineering <releng at fedoraproject dot org> - 2.1.1-3 | - Rebuilt for https://fedoraproject.org/wiki/Fedora_38_Mass_Rebuild |
| 2022-10-25 | Susi Lehtola <jussilehtola at fedoraproject dot org> - 2.1.1-2 | - Rebuild with libxc 6.0.0 in rawhide. |
| 2022-09-26 | Susi Lehtola <jussilehtola at fedoraproject dot org> - 2.1.1-1 | - Update to 2.1.1. |
| 2022-09-04 | Susi Lehtola <jussilehtola at fedoraproject dot org> - 2.1.0-1 | - Update to 2.1.0. |
| 2022-07-22 | Fedora Release Engineering <releng at fedoraproject dot org> - 2.0.1-6 | - Rebuilt for https://fedoraproject.org/wiki/Fedora_37_Mass_Rebuild |
| 2022-06-14 | Python Maint <python dash maint at redhat dot com> - 2.0.1-5 | - Rebuilt for Python 3.11 |
| 2022-01-21 | Fedora Release Engineering <releng at fedoraproject dot org> - 2.0.1-4 | - Rebuilt for https://fedoraproject.org/wiki/Fedora_36_Mass_Rebuild |
| 2021-12-25 | Susi Lehtola <jussilehtola at fedoraproject dot org> - 2.0.1-3 | - Patch for libcint 5.1.x compatibility. |
Dependencies
- flexiblas-netlib
- glibc
- libcint
- libgcc
- libgomp
- libxc
- python2.7 = 3.11
- python3 = 3.11
- python3-numpy
- python3-scipy
- qcint
Provides
- python-pyscf
- python3-pyscf
- python3-pyscf(x86-64)
- python3.11-pyscf
Files
- usr/
- lib/
- .build-id/
- 0a/
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- d0/
- 137a30ff957606438cf8bb2c40850fd3c5f720
- 0a/
- .build-id/
- lib64/
- python3.11/
- site-packages/
- pyscf/
- __all__.py
- __config__.py
- __init__.py
- __pycache__/
- __all__.cpython-311.opt-1.pyc
- __all__.cpython-311.pyc
- __config__.cpython-311.opt-1.pyc
- __config__.cpython-311.pyc
- __init__.cpython-311.opt-1.pyc
- __init__.cpython-311.pyc
- post_scf.cpython-311.opt-1.pyc
- post_scf.cpython-311.pyc
- adc/
- __init__.py
- __pycache__/
- __init__.cpython-311.opt-1.pyc
- __init__.cpython-311.pyc
- dfadc.cpython-311.opt-1.pyc
- dfadc.cpython-311.pyc
- radc.cpython-311.opt-1.pyc
- radc.cpython-311.pyc
- radc_amplitudes.cpython-311.opt-1.pyc
- radc_amplitudes.cpython-311.pyc
- radc_ao2mo.cpython-311.opt-1.pyc
- radc_ao2mo.cpython-311.pyc
- radc_ea.cpython-311.opt-1.pyc
- radc_ea.cpython-311.pyc
- radc_ip.cpython-311.opt-1.pyc
- radc_ip.cpython-311.pyc
- radc_ip_cvs.cpython-311.opt-1.pyc
- radc_ip_cvs.cpython-311.pyc
- uadc.cpython-311.opt-1.pyc
- uadc.cpython-311.pyc
- uadc_amplitudes.cpython-311.opt-1.pyc
- uadc_amplitudes.cpython-311.pyc
- uadc_ao2mo.cpython-311.opt-1.pyc
- uadc_ao2mo.cpython-311.pyc
- uadc_ea.cpython-311.opt-1.pyc
- uadc_ea.cpython-311.pyc
- uadc_ip.cpython-311.opt-1.pyc
- uadc_ip.cpython-311.pyc
- uadc_ip_cvs.cpython-311.opt-1.pyc
- uadc_ip_cvs.cpython-311.pyc
- dfadc.py
- radc.py
- radc_amplitudes.py
- radc_ao2mo.py
- radc_ea.py
- radc_ip.py
- radc_ip_cvs.py
- test/
- test_radc/
- __pycache__/
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- test_H2O_radc_ea.cpython-311.pyc
- test_H2O_radc_ip.cpython-311.opt-1.pyc
- test_H2O_radc_ip.cpython-311.pyc
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- test_H2O_radc_outcore_ip.cpython-311.opt-1.pyc
- test_H2O_radc_outcore_ip.cpython-311.pyc
- test_N2_radc_ea.cpython-311.opt-1.pyc
- test_N2_radc_ea.cpython-311.pyc
- test_N2_radc_ip.cpython-311.opt-1.pyc
- test_N2_radc_ip.cpython-311.pyc
- test_N2_radc_ip_cvs.cpython-311.opt-1.pyc
- test_N2_radc_ip_cvs.cpython-311.pyc
- test_approx_trans_mom.cpython-311.opt-1.pyc
- test_approx_trans_mom.cpython-311.pyc
- test_dfadc_N2.cpython-311.opt-1.pyc
- test_dfadc_N2.cpython-311.pyc
- test_H2O_radc_ea.py
- test_H2O_radc_ip.py
- test_H2O_radc_ip_cvs.py
- test_H2O_radc_outcore_ea.py
- test_H2O_radc_outcore_ip.py
- test_N2_radc_ea.py
- test_N2_radc_ip.py
- test_N2_radc_ip_cvs.py
- test_approx_trans_mom.py
- test_dfadc_N2.py
- __pycache__/
- test_uadc/
- __pycache__/
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- test_N2_uadc_ip.cpython-311.pyc
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- test_N2_uadc_ip_cvs.cpython-311.pyc
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- test_P_uadc_ip_cvs.cpython-311.opt-1.pyc
- test_P_uadc_ip_cvs.cpython-311.pyc
- test_dfadc_OH.cpython-311.opt-1.pyc
- test_dfadc_OH.cpython-311.pyc
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- test_N2_uadc_ip.py
- test_N2_uadc_ip_cvs.py
- test_OH_uadc_ea.py
- test_OH_uadc_ip.py
- test_OH_uadc_ip_cvs.py
- test_OH_uadc_outcore_ea.py
- test_OH_uadc_outcore_ip.py
- test_P_uadc_ea.py
- test_P_uadc_ip.py
- test_P_uadc_ip_cvs.py
- test_dfadc_OH.py
- __pycache__/
- test_radc/
- uadc.py
- uadc_amplitudes.py
- uadc_ao2mo.py
- uadc_ea.py
- uadc_ip.py
- uadc_ip_cvs.py
- agf2/
- __init__.py
- __pycache__/
- __init__.cpython-311.opt-1.pyc
- __init__.cpython-311.pyc
- _agf2.cpython-311.opt-1.pyc
- _agf2.cpython-311.pyc
- aux_space.cpython-311.opt-1.pyc
- aux_space.cpython-311.pyc
- chempot.cpython-311.opt-1.pyc
- chempot.cpython-311.pyc
- chkfile.cpython-311.opt-1.pyc
- chkfile.cpython-311.pyc
- dfragf2.cpython-311.opt-1.pyc
- dfragf2.cpython-311.pyc
- dfuagf2.cpython-311.opt-1.pyc
- dfuagf2.cpython-311.pyc
- mpi_helper.cpython-311.opt-1.pyc
- mpi_helper.cpython-311.pyc
- ragf2.cpython-311.opt-1.pyc
- ragf2.cpython-311.pyc
- ragf2_slow.cpython-311.opt-1.pyc
- ragf2_slow.cpython-311.pyc
- uagf2.cpython-311.opt-1.pyc
- uagf2.cpython-311.pyc
- uagf2_slow.cpython-311.opt-1.pyc
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- _agf2.py
- aux_space.py
- chempot.py
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- __pycache__/
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- outcore.cpython-311.pyc
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- r_outcore.cpython-311.pyc
- semi_incore.cpython-311.opt-1.pyc
- semi_incore.cpython-311.pyc
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- nrr_outcore.py
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- r_outcore.py
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- test/
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- __pycache__/
- cc/
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- _ccsd.py
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- qcisd_slow.py
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- rccsd_lambda.py
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- test/
- __pycache__/
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- test_h2o.cpython-311.opt-1.pyc
- test_h2o.cpython-311.pyc
- test_momgfccsd.cpython-311.opt-1.pyc
- test_momgfccsd.cpython-311.pyc
- test_rccsd.cpython-311.opt-1.pyc
- test_rccsd.cpython-311.pyc
- test_rccsd_lambda.cpython-311.opt-1.pyc
- test_rccsd_lambda.cpython-311.pyc
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- test_uccsd_t.cpython-311.pyc
- test_2e.py
- test_addons.py
- test_bz.py
- test_ccsd_lambda.py
- test_ccsd_t.py
- test_dfccsd.py
- test_eom_gccsd.py
- test_eom_rccsd.py
- test_eom_uccsd.py
- test_gccsd.py
- test_gccsd_lambda.py
- test_gccsd_t.py
- test_h2o.py
- test_momgfccsd.py
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- __pycache__/
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- ci/
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- __init__.cpython-311.pyc
- addons.cpython-311.opt-1.pyc
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