Input 12-electronic_subsystem_propagators.02-expmid.inp

Commits > Commit 9a893b9dbe73f1d3f49cd24e2707361da541a5ca > Run foss-parallel-zen4: [foss2023a-mpi]

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060686608766762e+01 -1.060686608766760e+01 1.060000000000000e-13 -1.953992523340276e-14 PASS
Energy [step 20] -1.060647833783795e+01 -1.060647833783796e+01 1.060000000000000e-13 1.421085471520200e-14 PASS
Multipoles [step 0] -4.583603028379679e-15 -8.908015926463452e-16 4.090000000000000e-15 -3.692801435733334e-15 PASS
Multipoles [step 20] -1.108549608270532e-01 -1.108549608270478e-01 4.210000000000000e-15 -5.440092820663267e-15 FAIL
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