From 04883b578090ae2f147c60f773135d4a71ea4382 Mon Sep 17 00:00:00 2001 From: Matthias Krack Date: Thu, 1 May 2025 13:53:03 +0200 Subject: [PATCH] Adjust tolerances after Merlin update from RHEL7 to RHEL8 --- tests/QS/regtest-hfx/TEST_FILES.toml | 6 +++--- 1 file changed, 3 insertions(+), 3 deletions(-) diff --git a/tests/QS/regtest-hfx/TEST_FILES.toml b/tests/QS/regtest-hfx/TEST_FILES.toml index 4dbbc7e161..ad6bf5bc61 100644 --- a/tests/QS/regtest-hfx/TEST_FILES.toml +++ b/tests/QS/regtest-hfx/TEST_FILES.toml @@ -9,9 +9,9 @@ "H2O_pw.inp" = [{matcher="M022", tol=1.0E-14, ref=-3.7909363318}] "H2O_pw_a.inp" = [{matcher="M022", tol=1.0E-14, ref=-3.8596077254}] "H2O_pw_b.inp" = [{matcher="M022", tol=1.0E-14, ref=-1.9225142273}] -"4H2O-disk.inp" = [{matcher="E_total", tol=3e-13, ref=-303.0074785907947}] -"4H2O-mix-disk-ram.inp" = [{matcher="E_total", tol=3e-13, ref=-303.0074785907935}] -"4H2O-mix-disk-ram-on-the-fly.inp" = [{matcher="E_total", tol=3e-13, ref=-303.00747859079473}] +"4H2O-disk.inp" = [{matcher="E_total", tol=5e-13, ref=-303.0074785907947}] +"4H2O-mix-disk-ram.inp" = [{matcher="E_total", tol=5e-13, ref=-303.0074785907935}] +"4H2O-mix-disk-ram-on-the-fly.inp" = [{matcher="E_total", tol=5e-13, ref=-303.00747859079473}] "H2-hfx-rtp.inp" = [{matcher="E_total", tol=3e-13, ref=-0.76693532081765}] "H2-hfx-emd.inp" = [{matcher="M002", tol=1.0E-14, ref=-0.766935659110E+00}] "H2O-hfx-emd.inp" = [{matcher="M002", tol=1E-11, ref=-16.875928042}]