Match SCF convergence
Commits >
Commit abc749737cc12a5b79d975879ed425be2e62065f >
Run eb_fosscuda-2022a >
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')