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wrong dimensions in s2_out

This commit is contained in:
Anthony Scemama 2016-10-27 13:49:29 +02:00
parent 4b525172bc
commit 8802d98849

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@ -22,7 +22,7 @@ subroutine davidson_diag_hs2(dets_in,u_in,s2_out,dim_in,energies,sze,N_st,N_st_d
integer, intent(in) :: dim_in, sze, N_st, N_st_diag, Nint, iunit
integer(bit_kind), intent(in) :: dets_in(Nint,2,sze)
double precision, intent(inout) :: u_in(dim_in,N_st_diag)
double precision, intent(out) :: energies(N_st), s2_out(N_st)
double precision, intent(out) :: energies(N_st), s2_out(N_st_diag)
double precision, allocatable :: H_jj(:), S2_jj(:)
double precision :: diag_h_mat_elem