subroutine form_h(nC,nO,nV,nR,eO,eV,OOVV,t1,tau,hvv,hoo,hvo) ! Scuseria Eqs. (5), (6) and (7) implicit none ! Input variables integer,intent(in) :: nC,nO,nV,nR double precision,intent(in) :: eO(nO) double precision,intent(in) :: eV(nV) double precision,intent(in) :: OOVV(nO,nO,nV,nV) double precision,intent(in) :: t1(nO,nV) double precision,intent(in) :: tau(nO,nO,nV,nV) ! Local variables integer :: i,j,k,l integer :: a,b,c,d ! Output variables double precision,intent(out) :: hvv(nV,nV) double precision,intent(out) :: hoo(nO,nO) double precision,intent(out) :: hvo(nV,nO) hvv(:,:) = 0d0 do b=1,nV-nR hvv(b,b) = eV(b) do a=1,nV-nR do j=nC+1,nO do k=nC+1,nO do c=1,nV-nR hvv(b,a) = hvv(b,a) - OOVV(j,k,b,c)*tau(j,k,a,c) end do end do end do end do end do hoo(:,:) = 0d0 do i=nC+1,nO hoo(i,i) = eO(i) do j=nC+1,nO do k=nC+1,nO do b=1,nV-nR do c=1,nV-nR hoo(i,j) = hoo(i,j) + OOVV(j,k,b,c)*tau(i,k,b,c) end do end do end do end do end do hvo(:,:) = 0d0 do b=1,nV-nR do j=nC+1,nO do k=nC+1,nO do c=1,nV-nR hvo(b,j) = hvo(b,j) + OOVV(j,k,b,c)*t1(k,c) end do end do end do end do ! print*,'hvv',hvv end subroutine form_h