Input 15-electronic_system_restart.02-td_full.inp
Commits >
Commit 38482cef62d365e560a63bc8ea1cbd919ea4f861 >
Run intel_mpi_autotools: [intel2023a-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] | -1.060637353666431e+01 | -1.060637353666430e+01 | 1.060000000000000e-13 | -1.065814103640150e-14 | PASS |
| Multipoles [step 0] | -7.455686458837652e-16 | -8.908015926463452e-16 | 4.090000000000000e-15 | 1.452329467625801e-16 | PASS |
| Multipoles [step 20] | -1.265509664058025e-01 | -1.265509664058046e-01 | 4.850000000000000e-15 | 2.137179322403426e-15 | PASS |