Match y (O) (t=200 au)
Commits >
Commit 917d830e9234ff154f8a96d6b6c157a89a03a450 >
Run foss_autotools: [foss2023a-serial] >
Input 10-dftbplus_verlet.01-water.inp
Value | Reference | Precision | Status |
-8.897112984625568e-18 | -9.292331809823001e-18 | 1.000000000000000e-04 | PASS |
Command: LINEFIELD(dftbplus/td.general/coordinates, -1, 4)