Match SCF convergence
Commits >
Commit daa93de2f371acc02c8ba320d7b5759725cfd1f4 >
Run cmake_foss_2022a_full_mpi >
Input 02-h2o_pol_lr.01_h2o_gs.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-04 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')