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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
examples\local_orb\07-pipek_mezey.py
2 1 -
A
examples\cc\43-ccd.py
1 1 -
A
examples\gw\00-simple_gw.py
1 -
A
examples\dft\30-ao_value_on_grid.py
1 -
A
examples\gw\01-gw_cd.py
1 -
A
examples\ci\32-wfn_overlap.py
1 -
A
examples\df\42-overwrite_get_jk.py
2 1 -
A
examples\df\01-auxbasis.py
1 -
A
examples\mcscf\04-density_matrix.py
1 -
A
examples\df\11-access_df_tensor.py
1 -
A
examples\gto\21-concatenate_molecules.py
1 1 -
A
examples\df\40-precompute_df_integrals.py
1 -
A
examples\gto\22-range_separated_coulomb.py
1 -
A
examples\mcscf\12-c2_triplet_from_singlet_hf.py
1 -
A
examples\mcscf\11-casscf_with_uhf_uks.py
1 -
A
examples\gto\31-basis_set_exchange.py
1 -
A
examples\geomopt\11-with_ghost_atom.py
1 -
A
examples\fci\30-h6_scan.py
1 -
A
examples\eph\01-finite_difference_eph.py
1 -
A
examples\ao2mo\01-outcore.py
1 -
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