master
pyscf
Repository badge with A rating
View on GitHub
Grade
Name
Complexity
Churn
Issues
A
examples\agf2\10-dyson_orbitals.py
 1 -
A
examples\dft\30-ao_value_on_grid.py
 1 -
A
examples\cc\40-ccsd_custom_hamiltonian.py
 1 -
A
examples\cc\41-ccsd_custom_hamiltonian_noscf.py
1 1 -
A
docker\Dockerfile
 1 -
A
examples\cc\43-ccd.py
1 1 -
A
examples\agf2\01-simple_uagf2.py
 1 -
A
examples\ao2mo\20-eri_grad_hess.py
 1 -
A
examples\agf2\03-photoemission_spectra.py
 1 -
A
examples\ci\20-from_fci.py
 1 -
A
examples\agf2\05-agf2_moments.py
 1 -
A
examples\ao2mo\01-outcore.py
 1 -
A
examples\agf2\07-scs_agf2.py
 1 -
A
examples\cc\15-incore_mo_ccsd_t.py
 1 -
A
examples\dft\33-nlc_functionals.py
 1 -
A
examples\dft\32-broken_symmetry_dft.py
 1 -
A
examples\ci\32-wfn_overlap.py
 1 -
A
examples\cc\20-ip_ea_eom_ccsd.py
 1 -
A
examples\cc\14-ccsd_diis.py
 1 -
A
examples\ao2mo\21-spin_orbit_coupling.py
 1 -