Match SCF convergence
Commits >
Commit 705c4760eef009c58a165e8716adc8057257a566 >
Run intel-serial: [intel2023a-serial] >
Input 11-isotopes.01-deuterium.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-04 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')