Match SCF convergence
Commits >
Commit fb3b67f6830f0e047754886f078a46875acffbf8 >
Run foss-serial-min: [foss2022a-serial] >
Input 03-octopus_basics-total_energy_convergence.02-methane.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 3.380000000000000e-05 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')