Match SCF convergence
Commits >
Commit adf3952efd5c2bdc0cc9389163d26498c92cbe64 >
Run intel_mpi_omp_autotools: [intel2022a-mpi] >
Input 20-eigensolver.05-rmmdiis.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 4.810000000000000e-02 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')