Match SCF convergence
Commits >
Commit 1f10c93c74388b17aea6526c581521be8cd6aa14 >
Run spack_foss-2022a_serial_min >
Input 20-eigensolver.06-rmmdiis-noscalapack.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 4.810000000000000e-02 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')