Match SCF convergence
Commits >
Commit 6186e1f92bb6a84e4a2e679736ea9db4d0c9eca5 >
Run spack_intel-2022a_serial_omp >
Input 03-octopus_basics-total_energy_convergence.01-N_atom.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 5.000000000000000e-03 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')