Input 15-electronic_system_restart.02-td_full.inp

Commits > Commit ee11de90c734467b7aebfc32d0117fe9ec1eea84 > Run spack_intel-2023a_serial_omp

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060684240205383e+01 -1.060684240205380e+01 5.300000000000000e-14 -3.197442310920451e-14 PASS
Energy [step 20] -1.060634982716858e+01 -1.060634982716860e+01 5.300000000000000e-13 1.598721155460225e-14 PASS
Multipoles [step 0] 3.536725599884161e-15 6.744248104320451e-16 4.500000000000000e-15 2.862300789452115e-15 PASS
Multipoles [step 20] -1.265513823311227e-01 -1.265513823311230e-01 6.700000000000000e-15 3.053113317719180e-16 PASS
Compare to other inputs