Match Total energy
Commits >
Commit 4eed2c655b9f478fca43a397c5feb863f7436add >
Run eb_foss-2022a_ppc >
Input 03-sodium_chain.01-ground_state.inp
Value | Reference | Precision | Status |
2.021960140000000e+00 | 2.021960160000000e+00 | 1.010000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)