Match SCF convergence
Commits >
Commit 6873b983d1904fe0612bd483f61737dd2d8ed971 >
Run foss-cmake-zen4: [foss2023a-serial, foss-full] >
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')