Match Total energy
Commits >
Commit 6099f031302cffa2938f492784ba2f7b55faffa3 >
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)