Input 15-electronic_system_restart.04-td_restart_part2.inp
Commits >
Commit 3f3300a09a325083399ad405019c399609c6d1c2 >
Run foss_mpi_debug_autotools: [foss2023a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 0] | -1.060686608766763e+01 | -1.060686608766760e+01 | 1.060000000000000e-13 | -3.197442310920451e-14 | PASS |
| Energy [step 20] | -1.060637353666430e+01 | -1.060637353666430e+01 | 1.060000000000000e-13 | -1.776356839400250e-15 | PASS |
| Multipoles [step 0] | -9.533494599225229e-16 | -8.908015926463452e-16 | 4.090000000000000e-15 | -6.254786727617767e-17 | PASS |
| Multipoles [step 20] | -1.265509664058039e-01 | -1.265509664058046e-01 | 4.850000000000000e-15 | 6.661338147750939e-16 | PASS |