xmolecule_get_mullikencharge Subroutine

public subroutine xmolecule_get_mullikencharge(xdata_cptr, charge, l_charge) bind(c)

returns mulliken charges

Arguments

Type	Intent	Optional	Attributes		Name
type(c_ptr),	intent(inout)			::	xdata_cptr
real(kind=c_double),	intent(inout)			::	charge(l_charge)
integer(kind=c_int),	intent(inout)			::	l_charge