Input 23-go-na2.03-fire.inp

Commits > Commit 49118372ba86b967cc9f5fccbbf24835f53b10d7 > Run cmake_foss_2022a_min_mpi

Matches

Name Value Reference Precision Difference Status
Total energy -4.169940300000000e-01 -4.169940000000000e-01 2.080000000000000e-07 -3.000000003972048e-08 PASS
Force [1] 3.849769810000000e-03 3.849761110000000e-03 9.570000000000001e-09 8.699999999930985e-09 PASS
Force [2] -3.849769810000000e-03 -3.849761110000000e-03 9.570000000000001e-09 -8.699999999930985e-09 PASS
Geometry [1] -1.565792000000000e+00 -1.565792000000000e+00 7.830000000000000e-06 0.000000000000000e+00 PASS
Geometry [2] 1.565792000000000e+00 1.565792000000000e+00 7.830000000000000e-06 0.000000000000000e+00 PASS
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