subroutine unrestricted_hybrid_exchange_individual_energy(DFA,nEns,wEns,nGrid,weight,nBas,ERI,Pw,P,rhow,drhow,rho,drho,Ex) ! Compute the hybrid exchange energy for individual states implicit none include 'parameters.h' ! Input variables integer,intent(in) :: DFA integer,intent(in) :: nEns double precision,intent(in) :: wEns(nEns) integer,intent(in) :: nGrid double precision,intent(in) :: weight(nGrid) double precision,intent(in) :: rhow(nGrid) double precision,intent(in) :: drhow(ncart,nGrid) double precision,intent(in) :: rho(nGrid) double precision,intent(in) :: drho(ncart,nGrid) integer,intent(in) :: nBas double precision,intent(in) :: ERI(nBas,nBas,nBas,nBas) double precision,intent(in) :: Pw(nBas,nBas) double precision,intent(in) :: P(nBas,nBas) ! Output variables double precision :: Ex ! Select correlation functional select case (DFA) case (1) call unrestricted_fock_exchange_individual_energy(nBas,Pw,P,ERI,Ex) case default call print_warning('!!! Hybrid exchange individual energy not available !!!') stop end select end subroutine unrestricted_hybrid_exchange_individual_energy