subroutine lda_exchange_individual_energy(DFA,LDA_centered,nEns,wEns,nCC,aCC,nGrid,weight,rhow,& rho,Cx_choice,doNcentered,LZx,Ex) ! Compute LDA exchange energy for individual states implicit none include 'parameters.h' ! Input variables logical,intent(in) :: LDA_centered integer,intent(in) :: DFA integer,intent(in) :: nEns double precision,intent(in) :: wEns(nEns) integer,intent(in) :: nCC double precision,intent(in) :: aCC(nCC,nEns-1) integer,intent(in) :: nGrid double precision,intent(in) :: weight(nGrid) double precision,intent(in) :: rhow(nGrid,nspin) double precision,intent(in) :: rho(nGrid,nspin,nEns) integer,intent(in) :: Cx_choice logical,intent(in) :: doNcentered ! Output variables double precision :: LZx(nspin) double precision :: Ex(nspin,nEns) ! Select correlation functional select case (DFA) case (1) call S51_lda_exchange_individual_energy(nEns,nGrid,weight,rhow,rho,LZx,Ex) case (2) call CC_lda_exchange_individual_energy(nEns,wEns,nCC,aCC,nGrid,weight,rhow,rho, & Cx_choice,doNcentered,LZx,Ex) case default call print_warning('!!! LDA exchange individual energy not available !!!') stop end select end subroutine lda_exchange_individual_energy