Match SCF convergence
Commits >
Commit 4104ea28a473696fae3c7fad4406bf86d5f6976c >
Run foss-mpi-min: [foss2023a-mpi] >
Input 21-qedft-breit-3d.02-pxlda-helium.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 2.300000000000000e-07 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')