h Function

public elemental function h(i, a)

Return the 1el integral

I and A are spatial indices. Follows the definition of the purple book.

The function exists to have a direct translation of the pen and paper equations into code.

Arguments

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

Spatial orbital indices

integer, intent(in) :: a

Spatial orbital indices

Return Value real(kind=dp)