Input 19-intra_interaction.01-ions.inp
Commits >
Commit efc44ae2259e56922145db535c825ce53e4127cb >
Run foss_cmake: [foss2023a-mpi, foss-min-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Ion 1 pos x (t=2 steps) | 1.006517647486013e+00 | 1.006517647486013e+00 | 1.100000000000000e-04 | 0.000000000000000e+00 | PASS |
| Ion 1 pos y (t=2 steps) | 1.000000000000000e-04 | 1.000000000000000e-04 | 1.100000000000000e-04 | 0.000000000000000e+00 | PASS |
| Ion 1 pos z (t=2 steps) | 1.000000000000000e-04 | 1.000000000000000e-04 | 1.100000000000000e-04 | 0.000000000000000e+00 | PASS |
| Ion 2 pos x (t=2 steps) | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.100000000000000e-04 | 0.000000000000000e+00 | PASS |
| Ion 2 pos y (t=2 steps) | 1.000000000000000e-04 | 1.000000000000000e-04 | 1.100000000000000e-04 | 0.000000000000000e+00 | PASS |
| Ion 2 pos z (t=2 steps) | 1.000000000000000e-04 | 1.000000000000000e-04 | 1.100000000000000e-04 | 0.000000000000000e+00 | PASS |
| Ion 1 vel x (t=2 steps) | 6.503574877578511e-03 | 6.503574877578511e-03 | 1.100000000000000e-04 | 0.000000000000000e+00 | PASS |
| Ion 1 vel y (t=2 steps) | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.100000000000000e-04 | 0.000000000000000e+00 | PASS |
| Ion 1 vel z (t=2 steps) | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.100000000000000e-04 | 0.000000000000000e+00 | PASS |
| Ion 2 vel x (t=2 steps) | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.100000000000000e-04 | 0.000000000000000e+00 | PASS |
| Ion 2 vel y (t=2 steps) | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.100000000000000e-04 | 0.000000000000000e+00 | PASS |
| Ion 2 vel z (t=2 steps) | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.100000000000000e-04 | 0.000000000000000e+00 | PASS |
| Ions Total energy (t=2 steps) | 6.000000470677402e+00 | 6.000000470677402e+00 | 1.100000000000000e-04 | 0.000000000000000e+00 | PASS |
| Ions Kinetic energy (t=2 steps) | 3.885312767129964e-02 | 3.885312767129964e-02 | 1.100000000000000e-04 | 0.000000000000000e+00 | PASS |
| Ions Potential energy (t=2 steps) | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.100000000000000e-04 | 0.000000000000000e+00 | PASS |
| Ions Internal energy (t=2 steps) | 5.961147343006102e+00 | 5.961147343006102e+00 | 1.100000000000000e-04 | 0.000000000000000e+00 | PASS |