Match Fy (H) (t=200 au)
Commits >
Commit 4ba99df89cd19114311b0fcb367f44d4f4e26fb8 >
Run intel_omp_autotools: [intel2023a-serial] >
Input 10-dftbplus_verlet.01-water.inp
| Value | Reference | Precision | Status |
| 5.481873625596164e-17 | 5.933449656873000e-17 | 1.000000000000000e-04 | PASS |
Command: LINEFIELD(dftbplus/td.general/forces, -1, 10)