Match y (C3) (t=400 au)
Commits >
Commit b27eded3d993de0343d6f1363463df82eb2e5c60 >
Run foss_cmake: [foss2023a-mpi, foss-full-mpi] >
Input 11-dftbplus_ehrenfest.01-benzene.inp
| Value | Reference | Precision | Status |
| 9.455131180888308e-01 | 9.455055999999999e-01 | 1.000000000000000e-04 | PASS |
Command: LINEFIELD(benzene/td.general/coordinates, -1, 10)