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master
pyscf
281
issues
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pull requests
1,225
files
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CodeFactor Rating A
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Grade
Name
Complexity
Churn
Issues
A
examples\local_orb\10-modify_valence_space_for_meta_lowdin.py
1
-
A
examples\df\01-auxbasis.py
1
-
A
examples\local_orb\nlocal.py
2
-
A
.github\workflows\ci.yml
10
-
A
examples\local_orb\ulocal.py
2
-
A
examples\df\11-access_df_tensor.py
1
-
A
examples\mcscf\00-simple_casscf.py
3
-
A
examples\adc\04-open_shell_different_setup.py
2
-
A
examples\mcscf\02-cas_space_spin.py
1
-
A
examples\df\40-precompute_df_integrals.py
1
-
A
examples\mcscf\04-density_matrix.py
1
-
A
doc_legacy\source\nao\examples\xyz2fdf.py
3
1
3
A
examples\1-advanced\002-input_script.py
2
-
A
examples\agf2\10-dyson_orbitals.py
1
-
A
examples\fci\15-FCI_hamiltonian.py
1
-
A
examples\fci\30-h6_scan.py
1
-
A
examples\ao2mo\00-mo_integrals.py
2
-
A
examples\fci\31-apply_2nd_quantized_op.py
1
-
A
examples\fci\32-wfn_overlap.py
2
-
A
examples\df\42-overwrite_get_jk.py
2
1
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