Match z (H) (t=200 au)
Commits >
Commit 1f10c93c74388b17aea6526c581521be8cd6aa14 >
Run spack_foss-2023a_serial >
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)