Match SCF convergence
Commits >
Commit 85779d3dd9ec6e18544835020e079bae8c405b87 >
Run spack_intel-2023a_impi >
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')