Input 15-electronic_system_restart.04-td_restart_part2.inp
Commits >
Commit c9606f298ccf4e57d14167459d26815f7508aa3e >
Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 0] | -1.060686608766762e+01 | -1.060686608766760e+01 | 1.060000000000000e-13 | -1.776356839400250e-14 | PASS |
| Energy [step 20] | -1.060637353666430e+01 | -1.060637353666430e+01 | 1.060000000000000e-13 | -1.776356839400250e-15 | PASS |
| Multipoles [step 0] | -2.100218436662527e-15 | 6.744248104320451e-16 | 4.500000000000000e-15 | -2.774643247094572e-15 | PASS |
| Multipoles [step 20] | -1.265509664058025e-01 | -1.265509664058043e-01 | 4.530000000000000e-15 | 1.748601263784622e-15 | PASS |