Match SCF convergence
Commits >
Commit 9a893b9dbe73f1d3f49cd24e2707361da541a5ca >
Run foss-serial-zen4: [foss2023a-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')