Input 15-electronic_system_restart.02-td_full.inp

Commits > Commit f22bb0bcca4b53614d336c5e83de089ff68b1baa > Run foss-mpi-min: [foss2022a-mpi]

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060686608766763e+01 -1.060686608766760e+01 1.060000000000000e-13 -3.019806626980426e-14 PASS
Energy [step 20] -1.060637353666430e+01 -1.060637353666430e+01 1.060000000000000e-13 -3.552713678800501e-15 PASS
Multipoles [step 0] 3.421849046789886e-15 -8.908015926463452e-16 5.000000000000000e-15 4.312650639436231e-15 PASS
Multipoles [step 20] -1.265509664058016e-01 -1.265509664058046e-01 5.000000000000000e-15 2.969846590872294e-15 PASS
Compare to other inputs