Match z (H1) (t=400 au)
Commits >
Commit e7de9bbf531ff65a0d18444fdbe173713a455724 >
Run foss_ppc_autotools: [foss2022a-serial] >
Input 11-dftbplus_ehrenfest.01-benzene.inp
| Value | Reference | Precision | Status |
| 2.388644100081892e+00 | 2.388638060000000e+00 | 1.000000000000000e-04 | PASS |
Command: LINEFIELD(benzene/td.general/coordinates, -1, 23)