Match Total energy
Commits >
Commit 968a3ff7080ffa1f89f08d37efc7416527769dec >
Run intel_omp_autotools: [intel2023a-serial] >
Input 03-sodium_chain.01-ground_state.inp
| Value | Reference | Precision | Status |
| 2.021960120000000e+00 | 2.021960160000000e+00 | 1.010000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)