Match Energy [step 20]
Commits >
Commit 57f8ca8d342504024fed98c8f4356f69f5870627 >
Run cuda-mpi-omp: [foss2022a-cuda-mpi] >
Input 05-lithium.02-td.inp
Value | Reference | Precision | Status |
-5.157472968412147e-01 | -5.157472968414080e-01 | 8.530000000000000e-13 | PASS |
Command: LINEFIELD(td.general/energy, -1, 3)