Match SCF convergence
Commits >
Commit b7dcc99023940be2b83de00317ffa33e598f3f55 >
Run foss_autotools: [foss2023b-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')