Input 15-electronic_system_restart.02-td_full.inp

Commits > Commit 6186e1f92bb6a84e4a2e679736ea9db4d0c9eca5 > Run spack_foss-2023a_serial_omp

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060684240205381e+01 -1.060684240205380e+01 5.300000000000000e-14 -1.421085471520200e-14 PASS
Energy [step 20] -1.060634982716858e+01 -1.060634982716860e+01 5.300000000000000e-13 2.309263891220326e-14 PASS
Multipoles [step 0] 3.155093374063167e-15 6.744248104320451e-16 4.500000000000000e-15 2.480668563631122e-15 PASS
Multipoles [step 20] -1.265513823311239e-01 -1.265513823311230e-01 6.700000000000000e-15 -8.604228440844963e-16 PASS
Compare to other inputs