Input 12-electronic_subsystem_propagators.02-expmid.inp

Commits > Commit 57f8ca8d342504024fed98c8f4356f69f5870627 > Run cuda-serial: [foss2022a-cuda-mpi]

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060686608766757e+01 -1.060686608766760e+01 1.060000000000000e-13 3.197442310920451e-14 PASS
Energy [step 20] -1.060647833783795e+01 -1.060647833783796e+01 1.060000000000000e-13 1.421085471520200e-14 PASS
Multipoles [step 0] 3.956110341662294e-16 -8.908015926463452e-16 4.090000000000000e-15 1.286412626812575e-15 PASS
Multipoles [step 20] -1.108549608270473e-01 -1.108549608270478e-01 4.210000000000000e-15 4.579669976578771e-16 PASS
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