Input 15-electronic_system_restart.02-td_full.inp

Commits > Commit b7dcc99023940be2b83de00317ffa33e598f3f55 > Run foss_cmake: [foss2023a-mpi, foss-min-mpi]

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060686608766763e+01 -1.060686608766760e+01 1.060000000000000e-13 -2.664535259100376e-14 PASS
Energy [step 20] -1.060637353666431e+01 -1.060637353666430e+01 1.060000000000000e-13 -1.065814103640150e-14 PASS
Multipoles [step 0] -2.703875026709244e-15 6.744248104320451e-16 4.500000000000000e-15 -3.378299837141289e-15 PASS
Multipoles [step 20] -1.265509664058042e-01 -1.265509664058023e-01 4.920000000000000e-15 -1.859623566247137e-15 PASS
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