Match SCF convergence
Commits >
Commit bb161c2d0107cec853e686df3a469ebc444968d7 >
Run foss_debug_autotools: [foss2023a-serial] >
Input 28-carbon_big_box.01-ground_state.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-04 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')