Input 15-electronic_system_restart.04-td_restart_part2.inp

Commits > Commit 3874475d54e6d4931162c1a62f5667add8f8f561 > Run foss_mpi_opt_autotools: [foss2023a-mpi]

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060686608766763e+01 -1.060686608766760e+01 1.060000000000000e-13 -2.842170943040401e-14 PASS
Energy [step 20] -1.060637353666431e+01 -1.060637353666430e+01 1.060000000000000e-13 -5.329070518200751e-15 PASS
Multipoles [step 0] 5.813388710847710e-16 6.744248104320451e-16 4.500000000000000e-15 -9.308593934727405e-17 PASS
Multipoles [step 20] -1.265509664058022e-01 -1.265509664058023e-01 4.920000000000000e-15 8.326672684688674e-17 PASS
Compare to other inputs