Match SCF convergence
Commits >
Commit 4b7a334ce1857269604388697d6e11d007df5aba >
Run eb_foss-2022b_libxc6 >
Input 29-pcm_chlorine_anion.04-ground_state-n240.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 3.450000000000000e-07 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')