ci_procedure Subroutine

public subroutine ci_procedure(p, a, b, f, f2, output)

performs CI calculations

Arguments

Type IntentOptional Attributes Name
type(param), intent(in) :: p
type(atom_set), intent(in) :: a(:)
type(basis), intent(inout) :: b
type(wf_data), intent(inout) :: f
type(wf_data), intent(in), optional :: f2
integer, intent(in), optional :: output