get_wfpair_val_num Function

private elemental function get_wfpair_val_num(numi, numj) result(wfpair)

Get pairwise CN weighting factor for a given atomic number pair

Arguments

Type IntentOptional Attributes Name
integer, intent(in) :: numi

Atomic number i
integer, intent(in) :: numj

Atomic number i

Return Value real(kind=wp)

Pairwise CN weighting factor


Source Code

elemental function get_wfpair_val_num(numi, numj) result(wfpair)

   !> Atomic number i
   integer, intent(in) :: numi

   !> Atomic number i
   integer, intent(in) :: numj

   !> Pairwise CN weighting factor
   real(wp) :: wfpair

   wfpair = weight_factors(numi, numj)

end function get_wfpair_val_num