Input 15-electronic_system_restart.02-td_full.inp

Commits > Commit eddb1a976bbe1f1b2f6bb64793dd776e6572a2b5 > Run foss-mpi-min: [foss2023a-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 -1.776356839400250e-15 PASS
Multipoles [step 0] 8.965783437940925e-17 -8.908015926463452e-16 4.090000000000000e-15 9.804594270257544e-16 PASS
Multipoles [step 20] -1.265509664058028e-01 -1.265509664058046e-01 4.850000000000000e-15 1.831867990631508e-15 PASS
Compare to other inputs