returns a list of occupations, constructed from N_occ by redistributing electrons wihtin the orbitals given in active_space_MO
Type | Intent | Optional | Attributes | Name | ||
---|---|---|---|---|---|---|
integer, | intent(in) | :: | n_occ(:) | |||
integer, | intent(in) | :: | active_space_mo(:) | |||
integer, | intent(out), | allocatable | :: | occs(:,:) |