subroutine hybrid_exchange_derivative_discontinuity(DFA,nEns,wEns,nCC,aCC,nGrid,weight,rhow,& Cx_choice,doNcentered,ExDD) ! Compute the exchange part of the derivative discontinuity for hybrid functionals implicit none include 'parameters.h' ! Input variables 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) integer,intent(in) :: Cx_choice logical,intent(in) :: doNcentered ! Local variables ! Output variables double precision,intent(out) :: ExDD(nEns) ! Select exchange functional select case (DFA) case (1) ExDD(:) = 0d0 case (2) ExDD(:) = 0d0 case (3) ExDD(:) = 0d0 case default call print_warning('!!! Hybrid exchange derivative discontinuity not available !!!') stop end select end subroutine hybrid_exchange_derivative_discontinuity