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

Commits > Commit 57f8ca8d342504024fed98c8f4356f69f5870627 > Run foss-mpi-full: [foss2023a-mpi]

Matches

Name Value Reference Precision Difference Status
Total energy -4.170733000000000e-01 -4.170733000000000e-01 2.090000000000000e-06 0.000000000000000e+00 PASS
Force [1] 3.690060130000000e-03 3.690060130000000e-03 1.850000000000000e-10 0.000000000000000e+00 PASS
Force [2] -3.690060130000000e-03 -3.690060130000000e-03 1.850000000000000e-10 0.000000000000000e+00 PASS
Geometry [1] -1.560549000000000e+00 -1.560549000000000e+00 7.800000000000000e-06 0.000000000000000e+00 PASS
Geometry [2] 1.560549000000000e+00 1.560549000000000e+00 7.800000000000000e-06 0.000000000000000e+00 PASS
Compare to other inputs