Match y (H) (t=200 au)
Commits >
Commit 65c9d1acfcf72851dda73eaed77edd797333194c >
Run foss-mpi-opt-full: [foss2023a-mpi] >
Input 10-dftbplus_verlet.01-water.inp
| Value | Reference | Precision | Status |
| -1.181020531078158e-17 | 8.726150915050000e-17 | 1.000000000000000e-04 | PASS |
Command: LINEFIELD(dftbplus/td.general/coordinates, -1, 10)