Input 15-electronic_system_restart.02-td_full.inp

Commits > Commit fa579c158b779976d5f0fa5d04f6d011c21f022f > Run spack_foss-2023a_serial_debug

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060684240205381e+01 -1.060684240205380e+01 5.300000000000000e-14 -1.065814103640150e-14 PASS
Energy [step 20] -1.060634982716856e+01 -1.060634982716860e+01 5.300000000000000e-13 3.552713678800501e-14 PASS
Multipoles [step 0] 1.913757116645508e-15 6.744248104320451e-16 4.500000000000000e-15 1.239332306213463e-15 PASS
Multipoles [step 20] -1.265513823311247e-01 -1.265513823311230e-01 6.700000000000000e-15 -1.665334536937735e-15 PASS
Compare to other inputs