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pyscf
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  • 281 issues
  • 0 pull requests
  • 1,225 files
  • 1 active branch

CodeFactor Rating A

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Grade
Name
Complexity
Churn
Issues
A
conda\conda_build_config.yaml
1 -
A
examples\ao2mo\21-spin_orbit_coupling.py
1 -
A
examples\1-advanced\031-density.py
1 -
A
examples\cc\00-simple_ccsd.py
2 -
A
.github\workflows\ci_macos\python_deps.sh
3 -
A
examples\cc\01-density_matrix.py
3 -
A
examples\1-advanced\033-constrained_dft.py
50 1 -
A
examples\cc\10-ao_direct_ccsd.py
1 -
A
.github\workflows\ci_linux\deps_apt.sh
1 -
A
examples\cc\12-reuse_integrals.py
2 -
A
examples\2-benchmark\benchmarking_utils.py
6 1 -
A
examples\cc\14-ccsd_diis.py
1 -
A
examples\cc\41-ccsd_custom_hamiltonian_noscf.py
1 1 -
A
examples\ci\00-simple_cisd.py
2 -
A
examples\cc\43-ccd.py
1 1 -
A
examples\cc\40-ccsd_custom_hamiltonian.py
1 -
A
.codecov.yml
2 -
A
conda\build.sh
3 -
A
examples\1-advanced\018-dmrg_casscf_for_feporph.py
3 1 -
A
examples\ao2mo\01-outcore.py
1 -
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