Match z (H) (t=200 au)
Commits >
Commit b27eded3d993de0343d6f1363463df82eb2e5c60 >
Run foss-mpi-full: [foss2023a-mpi] >
Input 10-dftbplus_verlet.01-water.inp
| Value | Reference | Precision | Status |
| 7.390503166186505e-01 | 7.390503166185000e-01 | 1.000000000000000e-04 | PASS |
Command: LINEFIELD(dftbplus/td.general/coordinates, -1, 8)