Match z (C6) (t=400 au)
Commits >
Commit b2c9b4a951ad3e3faeb99c2d543d652f634c0371 >
Run cmake_foss_2022a_full_serial >
Input 11-dftbplus_ehrenfest.01-benzene.inp
| Value | Reference | Precision | Status |
| 1.035393735233167e+00 | 1.035385160000000e+00 | 1.000000000000000e-04 | PASS |
Command: LINEFIELD(benzene/td.general/coordinates, -1, 20)