Match Initial energy
Commits >
Commit 57f8ca8d342504024fed98c8f4356f69f5870627 >
Run cuda-mpi-omp: [foss2022a-cuda-mpi] >
Input 06-caetrs.01-gs.inp
Value | Reference | Precision | Status |
-1.058482984000000e+01 | -1.058482984000000e+01 | 5.290000000000000e-08 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)