Input 05-time_propagation.05-td_md.inp
Commits >
Commit 0fe8dcc2cda723db7bfa614b73e6eb662c8bbe1e >
Run foss_cmake: [foss2022a-mpi, foss-min-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 1] | -3.791009280177389e+01 | -3.791009280177000e+01 | 1.900000000000000e-10 | -3.886668764607748e-12 | PASS |
| Energy [step 5] | -3.791008856892499e+01 | -3.791008856893000e+01 | 1.900000000000000e-10 | 5.009326287108706e-12 | PASS |
| Energy [step 10] | -3.791001520298096e+01 | -3.791001520298000e+01 | 1.900000000000000e-10 | -9.592326932761353e-13 | PASS |