Match SCF convergence
Commits >
Commit 34a88ed67d1e43cec43030663c55a516d3c2803d >
Run cmake_foss_2022a_full_mpi >
Input 33-cg.03-cg_direction.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 4.780000000000000e-02 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')