Match Energy [step 20]
Commits >
Commit b21946569e0fd76bd0c736308c1aade8f51fa7e4 >
Run cuda-mpi-omp: [foss2022a-cuda-mpi] >
Input 14-fullerene_unpacked.02-td-unpacked.inp
| Value | Reference | Precision | Status |
| -3.184094654954757e+02 | -3.184094654954693e+02 | 5.150000000000000e-11 | PASS |
Command: LINEFIELD(td.general/energy, -1, 3)