xmolecule_set_occ Subroutine

public recursive subroutine xmolecule_set_occ(xdata_cptr, occ_in, l_occ_in) bind(c)

sets occupation numbers

Arguments

Type IntentOptional Attributes Name
type(c_ptr), intent(inout) :: xdata_cptr
integer(kind=c_int), intent(in) :: occ_in(l_occ_in)
integer(kind=c_int), intent(in) :: l_occ_in