Input 15-electronic_system_restart.02-td_full.inp

Commits > Commit f1dbe11076ccb3bb542605fe66566061d8720041 > Run spack_foss-2022a_ppc

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060684240205380e+01 -1.060684240205380e+01 5.300000000000000e-14 -3.552713678800501e-15 PASS
Energy [step 20] -1.060634982716856e+01 -1.060634982716860e+01 5.300000000000000e-13 3.907985046680551e-14 PASS
Multipoles [step 0] 2.128942103174231e-15 6.744248104320451e-16 4.500000000000000e-15 1.454517292742186e-15 PASS
Multipoles [step 20] -1.265513823311226e-01 -1.265513823311230e-01 6.700000000000000e-15 3.885780586188048e-16 PASS
Compare to other inputs