Match z (H3) (t=400 au)
Commits >
Commit c1843387c3c25bf42356cee40f04165a0aff5f6f >
Run foss-serial-full: [foss2023a-serial] >
Input 11-dftbplus_ehrenfest.01-benzene.inp
| Value | Reference | Precision | Status |
| -1.828441781078594e+00 | -1.828435580000000e+00 | 1.000000000000000e-04 | PASS |
Command: LINEFIELD(benzene/td.general/coordinates, -1, 29)