From 2425201c8176af8ce0f3ff9d955a42a388d7aa6d Mon Sep 17 00:00:00 2001 From: Emmanuel Giner Date: Wed, 9 Jan 2019 15:52:36 +0100 Subject: [PATCH] changed save_singles to compute_singles --- src/davidson/u0_h_u0.irp.f | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/src/davidson/u0_h_u0.irp.f b/src/davidson/u0_h_u0.irp.f index 0c7f18c9..3638d5b5 100644 --- a/src/davidson/u0_h_u0.irp.f +++ b/src/davidson/u0_h_u0.irp.f @@ -166,7 +166,7 @@ subroutine H_S2_u_0_nstates_openmp_work_$N_int(v_t,s_t,u_t,N_st,sze,istart,iend, !$OMP psi_bilinear_matrix_columns_loc, & !$OMP psi_bilinear_matrix_transp_rows_loc, & !$OMP istart, iend, istep, irp_here, v_t, s_t, & - !$OMP ishift, idx0, u_t, maxab, save_singles) & + !$OMP ishift, idx0, u_t, maxab, compute_singles) & !$OMP PRIVATE(krow, kcol, tmp_det, spindet, k_a, k_b, i, & !$OMP lcol, lrow, l_a, l_b, & !$OMP buffer, doubles, n_doubles, &