xc_xwpbe.F File Reference

#include "../base/base_uses.f90"

Go to the source code of this file.

Modules
module	xc_xwpbe
	Calculates short range exchange part for wPBE functional and averaged PBE exchange-hole functional (omega = 0.0 ).

Functions/Subroutines
subroutine, public	xc_xwpbe::xwpbe_lda_info (reference, shortform, needs, max_deriv)
	return various information on the functional
subroutine, public	xc_xwpbe::xwpbe_lda_eval (rho_set, deriv_set, order, xwpbe_params)
	evaluates the screened hole averaged PBE exchange functional for lda
subroutine, public	xc_xwpbe::xwpbe_lsd_info (reference, shortform, needs, max_deriv)
	return various information on the functional
subroutine, public	xc_xwpbe::xwpbe_lsd_eval (rho_set, deriv_set, order, xwpbe_params)
	evaluates the screened hole averaged PBE exchange functional for lsd