subroutine create_selection_buffer(N, siz, res) use selection_types implicit none integer, intent(in) :: N, siz type(selection_buffer), intent(out) :: res allocate(res%det(N_int, 2, siz), res%val(siz)) res%val = 0d0 res%det = 0_8 res%N = N res%mini = 0d0 res%cur = 0 end subroutine subroutine add_to_selection_buffer(b, det, val) use selection_types implicit none type(selection_buffer), intent(inout) :: b integer(bit_kind), intent(in) :: det(N_int, 2) double precision, intent(in) :: val integer :: i if(val <= b%mini) then b%cur += 1 b%det(1:N_int,1:2,b%cur) = det(1:N_int,1:2) b%val(b%cur) = val if(b%cur == size(b%val)) then call sort_selection_buffer(b) end if end if end subroutine subroutine sort_selection_buffer(b) use selection_types implicit none type(selection_buffer), intent(inout) :: b integer, allocatable :: iorder(:) integer(bit_kind), pointer :: detmp(:,:,:) integer :: i, nmwen logical, external :: detEq nmwen = min(b%N, b%cur) allocate(iorder(b%cur), detmp(N_int, 2, size(b%det,3))) do i=1,b%cur iorder(i) = i end do call dsort(b%val, iorder, b%cur) do i=1, nmwen detmp(1:N_int,1,i) = b%det(1:N_int,1,iorder(i)) detmp(1:N_int,2,i) = b%det(1:N_int,2,iorder(i)) end do deallocate(b%det) b%det => detmp b%mini = min(b%mini,b%val(b%N)) b%cur = nmwen deallocate(iorder) end subroutine