place_ag_on_grid3d Subroutine

public subroutine place_ag_on_grid3d(a, g, i_start)

place atomic grids for each atom on molecular grids

Arguments

Type IntentOptional Attributes Name
type(atom_set), intent(in) :: a
type(grid3d), intent(inout) :: g
integer, intent(in) :: i_start