Match SCF convergence
Commits >
Commit 1f10c93c74388b17aea6526c581521be8cd6aa14 >
Run cmake_foss_2022a_full_mpi >
Input 31-acetylene_b3lyp.01-gs.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-04 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')