subroutine gen_all_doubles_rs_hub_hop_transcorr(nI, n_excits, det_list)
integer, intent(in) :: nI(nel)
integer, intent(out) :: n_excits
integer(n_int), intent(out), allocatable :: det_list(:, :)
integer(n_int) :: ilut(0:NIfTot), ilutJ(0:NIfTot)
integer :: n_bound, i, src(2), j, ex(2, 2), pos, a, b
integer(n_int), allocatable :: temp_list(:, :)
real(dp) :: elem
call EncodeBitDet(nI, ilut)
n_excits = 1
n_bound = nel * (nel - 1) * (nbasis - nel) * (nbasis - nel - 1)
allocate(temp_list(0:NIfTot, n_bound))
temp_list = 0_n_int
! we just have opposite spin doubles!
do i = 1, nel - 1
do j = i + 1, nel
src = nI([i, j])
if (same_spin(src(1), src(2))) cycle
ex(1, :) = src
! and now loop over all possible empty spin opposite
! orbitals in a unique way..
do a = 1, nbasis - 1
if (IsOcc(ilut, a)) cycle
do b = a + 1, nbasis
if (IsOcc(ilut, b) .or. same_spin(a, b)) cycle
ex(2, :) = [a, b]
elem = abs(get_helement_lattice(nI, 2, ex, .false.))
if (elem > EPS) then
ilutJ = make_ilutJ(ilut, ex, 2)
! actually a search is not really necessary.. since
! all the single excitations are unique.. but
! just to be sure
pos = binary_search_ilut(temp_list(:, 1:n_excits), ilutJ, nifd + 1)
if (pos < 0) then
temp_list(:, n_excits) = ilutJ
call sort(temp_list(:, 1:n_excits), ilut_lt, ilut_gt)
n_excits = n_excits + 1
! damn.. i have to sort everytime i guess..
end if
end if
end do
end do
end do
end do
n_excits = n_excits - 1
allocate(det_list(0:NIfTot, n_excits), source=temp_list(:, 1:n_excits))
call sort(det_list, ilut_lt, ilut_gt)
end subroutine gen_all_doubles_rs_hub_hop_transcorr