pyscfad.pbc.scf.khf_lite.KSCFLite.get_occ

KSCFLite.get_occ(mo_energy_kpts=None, mo_coeff_kpts=None)

Get MO occupations.

Parameters:

• mf (KSCF)

• mo_energy_kpts (ArrayLike | None)

• mo_coeff_kpts (ArrayLike | None)

Return type:

Array