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xc_xbr_pbe_lda_hole_t_c_lr.F File Reference

Go to the source code of this file.

Modules

module  xc_xbr_pbe_lda_hole_t_c_lr
 This functional is a combination of three different exchange hole models. The ingredients are:
 

Functions/Subroutines

subroutine, public xc_xbr_pbe_lda_hole_t_c_lr::xbr_pbe_lda_hole_tc_lr_lda_info (reference, shortform, needs, max_deriv)
 return various information on the functional
 
subroutine, public xc_xbr_pbe_lda_hole_t_c_lr::xbr_pbe_lda_hole_tc_lr_lsd_info (reference, shortform, needs, max_deriv)
 return various information on the functional
 
subroutine, public xc_xbr_pbe_lda_hole_t_c_lr::xbr_pbe_lda_hole_tc_lr_lda_eval (rho_set, deriv_set, grad_deriv, params)
 Intermediate routine that gets grids, derivatives and some params.
 
subroutine, public xc_xbr_pbe_lda_hole_t_c_lr::xbr_pbe_lda_hole_tc_lr_lsd_eval (rho_set, deriv_set, grad_deriv, params)
 Intermediate routine that gets grids, derivatives and some params.