From 2f1a5e6618bbd2c8fe50fea3a058ee8238c4ee2c Mon Sep 17 00:00:00 2001 From: Anthony Scemama Date: Fri, 27 May 2022 19:00:06 +0200 Subject: [PATCH] Fix transition from new to old 4idx transformation --- src/mo_two_e_ints/mo_bi_integrals.irp.f | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/src/mo_two_e_ints/mo_bi_integrals.irp.f b/src/mo_two_e_ints/mo_bi_integrals.irp.f index c03b363d..ba5a069a 100644 --- a/src/mo_two_e_ints/mo_bi_integrals.irp.f +++ b/src/mo_two_e_ints/mo_bi_integrals.irp.f @@ -53,7 +53,7 @@ BEGIN_PROVIDER [ logical, mo_two_e_integrals_in_map ] ! call four_idx_novvvv call four_idx_novvvv_old else - if (ao_num*ao_num*ao_num*ao_num*32.d-9 < dble(qp_max_mem)) then + if (ao_num*ao_num*ao_num*ao_num*32.d-6 < dble(qp_max_mem)) then call four_idx_dgemm else call add_integrals_to_map(full_ijkl_bitmask_4)