From dbe90be7fb677275c0bd5daeed6cfd2708bec641 Mon Sep 17 00:00:00 2001 From: =?UTF-8?q?Ole=20Sch=C3=BCtt?= Date: Wed, 17 May 2023 11:18:36 +0200 Subject: [PATCH] Adjust threshold of QS/regtest-gpw-5/si8_pulay_off.inp --- tests/QS/regtest-gpw-5/TEST_FILES | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/tests/QS/regtest-gpw-5/TEST_FILES b/tests/QS/regtest-gpw-5/TEST_FILES index 0d90722d58..c092304d7f 100644 --- a/tests/QS/regtest-gpw-5/TEST_FILES +++ b/tests/QS/regtest-gpw-5/TEST_FILES @@ -15,7 +15,7 @@ si8_pulay_reduce.inp 1 2e-13 - si8_pulay_restore.inp 1 2e-13 -31.16058546019718 si8_pulay_inverse.inp 1 2e-13 -31.16058546019690 si8_pulay_inv_dbcsr.inp 1 3e-13 -31.16058546019509 -si8_pulay_off.inp 1 5e-13 -33.01431207828869 +si8_pulay_off.inp 1 7e-13 -33.01431207828869 # si8_pmix_nosmear_mocubes.inp 1 5e-13 -31.18760296986724 si8_pulay_mocubes.inp 1 5e-13 -31.16058546019718