Match SCF convergence
Commits >
Commit 70b0ad3565a7ed52254e6fb5a8a40b027abeb4a7 >
Run foss_autotools: [foss2023a-serial] >
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')