! BEGIN_PROVIDER [ logical, do_dress_with_alpha ] !&BEGIN_PROVIDER [ logical, do_dress_with_alpha_buffer ] !&BEGIN_PROVIDER [ logical, do_dress_with_generator ] ! implicit none ! do_dress_with_alpha = .false. ! do_dress_with_alpha_buffer = .true. ! do_dress_with_generator = .false. !END_PROVIDER subroutine dress_with_alpha_buffer(delta_ij_loc, minilist, n_minilist, abuf, n_abuf) use bitmasks implicit none double precision,intent(inout) :: delta_ij_loc(N_states,N_det,2) integer, intent(in) :: n_minilist, n_abuf integer(bit_kind),intent(in) :: abuf(N_int, 2, n_abuf) integer :: minilist(n_minilist) integer :: a, i, nref, nobt, deg integer :: refc(N_det), testc(N_det) do a=1,n_abuf refc = 0 testc = 0 do i=1,N_det call get_excitation_degree(psi_det_sorted(1,1,i), abuf(1,1,a), deg, N_int) if(deg <= 2) refc(i) = refc(i) + 1 end do do i=1,n_minilist call get_excitation_degree(psi_det_sorted(1,1,minilist(i)), abuf(1,1,a), deg, N_int) if(deg <= 2) then testc(minilist(i)) += 1 else stop "NON LIKED" end if end do do i=1,N_det if(refc(i) /= testc(i)) then print *, "foir ", sum(refc), sum(testc), n_minilist exit end if end do end do delta_ij_loc = 1d0 end subroutine