Input 15-electronic_system_restart.02-td_full.inp

Commits > Commit bb161c2d0107cec853e686df3a469ebc444968d7 > Run foss_autotools: [foss2023b-serial]

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060686608766759e+01 -1.060686608766760e+01 1.060000000000000e-13 7.105427357601002e-15 PASS
Energy [step 20] -1.060637353666431e+01 -1.060637353666430e+01 1.060000000000000e-13 -5.329070518200751e-15 PASS
Multipoles [step 0] -1.974469903982118e-15 6.744248104320451e-16 4.500000000000000e-15 -2.648894714414163e-15 PASS
Multipoles [step 20] -1.265509664058035e-01 -1.265509664058023e-01 2.600000000000000e-15 -1.221245327087672e-15 PASS
Compare to other inputs