bsse.F File Reference

#include "./base/base_uses.f90"

Go to the source code of this file.

Modules
module	bsse
	Module to perform a counterpoise correction (BSSE)

Functions/Subroutines
subroutine, public	bsse::do_bsse_calculation (force_env, globenv)
	Perform an COUNTERPOISE CORRECTION (BSSE) For a 2-body system the correction scheme can be represented as: