Match SCF convergence
Commits >
Commit 467aee6bb6aa6bf5b31aed5cccd88bd7f10f5124 >
Run cmake_foss_2022a_full_mpi >
Input 13-primitive.03-bcc_iron.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 8.389999999999999e-06 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')