Input 12-absorption.02-td.inp

Commits > Commit eddb1a976bbe1f1b2f6bb64793dd776e6572a2b5 > Run foss-mpi-min: [foss2022a-mpi]

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -5.810136966818389e+00 -5.810136966818370e+00 8.300000000000000e-14 -1.865174681370263e-14 PASS
Energy [step 25] -5.809755963265182e+00 -5.809755963265225e+00 7.030000000000000e-14 4.263256414560601e-14 PASS
Energy [step 50] -5.809755944335465e+00 -5.809755944335500e+00 8.160000000000000e-14 3.463895836830488e-14 PASS
Energy [step 75] -5.809755929708054e+00 -5.809755929708111e+00 7.720000000000000e-14 5.684341886080801e-14 PASS
Energy [step 100] -5.809755909085583e+00 -5.809755909085682e+00 1.140000000000000e-13 9.947598300641403e-14 PASS
Compare to other inputs