Match SCF convergence
Commits >
Commit 9972eae3cc35bad71f44bb929051f5e204f853a2 >
Run foss-mpi-opt-full: [foss2023a-mpi] >
Input 34-walltime.01-gs_walltime.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 7.000000000000000e-06 | PASS |
Command: GREPCOUNT(workdir/static/info, 'SCF \*not\* converged')