Match SCF convergence
Commits >
Commit 3c86545dbb6a164adc7b03c9886fea0d0acfc59e >
Run GCI_intel_mpi_autotools: [intel2023a-mpi] >
Input 01-xc_1d.02-wfs-hf.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 4.370000000000000e-05 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')