Match SCF convergence
Commits >
Commit 65c9d1acfcf72851dda73eaed77edd797333194c >
Run valgrind: [foss2023a-serial] >
Input 26-Na.01-gs.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-04 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')