set_refgw Interface

public interface set_refgw

Module Procedures

private pure subroutine set_refgw_sym(ngw, sym)

Set the number of gaussian weights for an element symbol

Arguments

Type IntentOptional Attributes Name
integer, intent(out) :: ngw(:)

Number of gaussian weights
character(len=*), intent(in) :: sym

Element symbol

private pure subroutine set_refgw_num(ngw, num)

Set the number of gaussian weights for an atomic number

Arguments

Type IntentOptional Attributes Name
integer, intent(out) :: ngw(:)

Number of gaussian weights
integer, intent(in) :: num

Atomic number