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Adjust tolerance of UO2-Morelon-5x5x5-cell_opt.inp

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Ole Schütt 2026-01-09 18:40:59 +01:00 • committed by Ole Schütt
parent a39db778ca
commit b842bfb1e3
1 changed files with 1 additions and 1 deletions
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2
tests/Fist/regtest-7-2/TEST_FILES.toml
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@ -68,5 +68,5 @@
"UO2-4x4x4-cs-fixd-nvt.inp" = [{matcher="M054", tol=1.0E-05, ref=4.107616E-02}]
"UO2-4x4x4-cs-fixd-npt.inp" = [{matcher="M054", tol=1.0E-05, ref=4.598688E-02}]
# Test UO2 force fields with generic input
"UO2-Morelon-5x5x5-cell_opt.inp" = [{matcher="M011", tol=5.0E-13, ref=-1210.562919201563318}]
"UO2-Morelon-5x5x5-cell_opt.inp" = [{matcher="M011", tol=1.0E-12, ref=-1210.562919201563318}]
#EOF