Match SCF convergence
Commits >
Commit d89ed1adec8f63937926022ba961c15ddb98b66b >
Run foss_cmake: [foss2022a-serial, foss-min] >
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')