xc_xlda_hole_t_c_lr.F File Reference

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

Go to the source code of this file.

Modules
module	xc_xlda_hole_t_c_lr
	Calculates the lda exchange hole in a truncated coulomb potential. Can be used as longrange correction for truncated hfx calculations.

Functions/Subroutines
subroutine, public	xc_xlda_hole_t_c_lr::xlda_hole_t_c_lr_lda_info (reference, shortform, needs, max_deriv)
	returns various information on the functional
subroutine, public	xc_xlda_hole_t_c_lr::xlda_hole_t_c_lr_lsd_info (reference, shortform, needs, max_deriv)
	returns various information on the functional
subroutine, public	xc_xlda_hole_t_c_lr::xlda_hole_t_c_lr_lda_eval (rho_set, deriv_set, order, params)
	evaluates the truncated lda exchange hole
subroutine, public	xc_xlda_hole_t_c_lr::xlda_hole_t_c_lr_lda_calc_0 (order, rho, e_0, e_rho, sx, r)
	low level routine
subroutine, public	xc_xlda_hole_t_c_lr::xlda_hole_t_c_lr_lsd_eval (rho_set, deriv_set, order, params)
	evaluates the truncated lsd exchange hole. Calls the lda routine and applies spin scaling relation