Input 15-electronic_system_restart.02-td_full.inp
Commits >
Commit 6099f031302cffa2938f492784ba2f7b55faffa3 >
Run intel_mpi_omp_autotools: [intel2022a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 0] | -1.060686608766763e+01 | -1.060686608766760e+01 | 1.060000000000000e-13 | -2.486899575160351e-14 | PASS |
| Energy [step 20] | -1.060637353666431e+01 | -1.060637353666430e+01 | 1.060000000000000e-13 | -5.329070518200751e-15 | PASS |
| Multipoles [step 0] | 1.085916512960639e-15 | 6.744248104320451e-16 | 4.500000000000000e-15 | 4.114917025285934e-16 | PASS |
| Multipoles [step 20] | -1.265509664058019e-01 | -1.265509664058023e-01 | 2.600000000000000e-15 | 4.440892098500626e-16 | PASS |