Match x (O) (t=200 au)
Commits >
Commit b2c9b4a951ad3e3faeb99c2d543d652f634c0371 >
Run intel-2022a >
Input 10-dftbplus_verlet.01-water.inp
Value | Reference | Precision | Status |
-4.733597774662083e-18 | 5.029474818285000e-15 | 1.000000000000000e-04 | PASS |
Command: LINEFIELD(dftbplus/td.general/coordinates, -1, 3)