Match SCF convergence
Commits >
Commit b1773e3237a9e3fe1d68ecd7146c17ebbd95a961 >
Run cmake_foss_2022a_min_mpi >
Input 06-restart.03-gs_mixvhxc.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 4.270000000000000e-05 | PASS |
Command: GREPCOUNT(workdir/static/info, 'SCF \*not\* converged')