Match SCF convergence
Commits >
Commit 6873b983d1904fe0612bd483f61737dd2d8ed971 >
Run foss-mpi-omp-full: [foss2023a-mpi] >
Input 13-primitive.03-bcc_iron.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 8.379999999999999e-06 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')