Match z (H1) (t=400 au)
Commits >
Commit bb161c2d0107cec853e686df3a469ebc444968d7 >
Run foss_omp_autotools: [foss2023a-serial] >
Input 11-dftbplus_ehrenfest.01-benzene.inp
| Value | Reference | Precision | Status |
| 2.388644100081863e+00 | 2.388638060000000e+00 | 1.000000000000000e-04 | PASS |
Command: LINEFIELD(benzene/td.general/coordinates, -1, 23)