Match x (O) (t=200 au)
Commits >
Commit 3c86545dbb6a164adc7b03c9886fea0d0acfc59e >
Run GCI_foss_ppc_autotools: [foss2022a-serial] >
Input 10-dftbplus_verlet.01-water.inp
| Value | Reference | Precision | Status |
| 4.685196397100306e-18 | 5.029474818285000e-15 | 1.000000000000000e-04 | PASS |
Command: LINEFIELD(dftbplus/td.general/coordinates, -1, 3)