Match x (H) (t=200 au)
Commits >
Commit f72050fe95608e153e1887ef05d1ad42dc082fde >
Run foss-cmake-zen4: [foss2023a-serial, foss-full] >
Input 10-dftbplus_verlet.01-water.inp
| Value | Reference | Precision | Status |
| 1.447837823412023e+00 | 1.447837823412000e+00 | 1.000000000000000e-04 | PASS |
Command: LINEFIELD(dftbplus/td.general/coordinates, -1, 6)