Match SCF convergence
Commits >
Commit 23cadfdc08b3b148a9c434cb52e4be78ff32991e >
Run foss_min_autotools: [foss2023b-serial] >
Input 16-sodium_chain_cylinder.03-ground_state_disp.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 5.910000000000000e-06 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')