Match SCF convergence
Commits >
Commit 38482cef62d365e560a63bc8ea1cbd919ea4f861 >
Run foss-mpi-debug: [foss2023a-mpi] >
Input 01-quadratic_box.02-hartree.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 5.000000000000000e-05 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')