(git:0de0cc2)
xc_xbecke88.F File Reference

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Modules

module  xc_xbecke88
 calculates the Becke 88 exchange functional
 

Functions/Subroutines

subroutine, public xc_xbecke88::xb88_lda_info (reference, shortform, needs, max_deriv)
 return various information on the functional More...
 
subroutine, public xc_xbecke88::xb88_lsd_info (reference, shortform, needs, max_deriv)
 return various information on the functional More...
 
subroutine, public xc_xbecke88::xb88_lda_eval (rho_set, deriv_set, grad_deriv, xb88_params)
 evaluates the becke 88 exchange functional for lda More...
 
subroutine, public xc_xbecke88::xb88_lsd_eval (rho_set, deriv_set, grad_deriv, xb88_params)
 evaluates the becke 88 exchange functional for lsd More...