Match z (C4) (t=400 au)
Commits >
Commit bf0f47cf3302df97f9487d18148dd4e0cf599eb9 >
Run eb_fosscuda-2022a >
Input 11-dftbplus_ehrenfest.01-benzene.inp
| Value | Reference | Precision | Status |
| -1.325022533299293e+00 | -1.325015210000000e+00 | 1.000000000000000e-04 | PASS |
Command: LINEFIELD(benzene/td.general/coordinates, -1, 14)