Input 22-multitrajectory.01-gs.inp
Commits >
Commit a02211b136400868a3f91e422c586cb9ab194975 >
Run foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Replica 1 converged | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-01 | 0.000000000000000e+00 | PASS |
| Replica 2 converged | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-01 | 0.000000000000000e+00 | PASS |
| Replica 3 converged | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-01 | 0.000000000000000e+00 | PASS |
| Replica 1 C x-pos | -7.639980000000000e-01 | -7.639980000000000e-01 | 1.000000000000000e-05 | 0.000000000000000e+00 | PASS |
| Replica 2 C x-pos | -7.511570000000000e-01 | -7.511570000000000e-01 | 1.000000000000000e-05 | 0.000000000000000e+00 | PASS |
| Replica 3 C x-pos | -7.269540000000000e-01 | -7.269540000000000e-01 | 1.000000000000000e-05 | 0.000000000000000e+00 | PASS |
| Replica 1 dipole | -1.128490000000000e-15 | 0.000000000000000e+00 | 3.000000000000000e-06 | -1.128490000000000e-15 | PASS |
| Replica 2 dipole | -4.034710000000000e-15 | 0.000000000000000e+00 | 3.000000000000000e-06 | -4.034710000000000e-15 | PASS |
| Replica 3 dipole | -3.704070000000000e-15 | 0.000000000000000e+00 | 3.000000000000000e-06 | -3.704070000000000e-15 | PASS |