Input 01-quadratic_box.04-spin_polarized.inp
Commits >
Commit eff5280d65f29f89ecacf7a6e9c2d06020a47460 >
Run intel_mpi_omp_autotools: [intel2022a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| SCF convergence | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-05 | 0.000000000000000e+00 | PASS |
| Total energy | 7.759250060000000e+00 | 7.759258320000000e+00 | 2.000000000000000e-05 | -8.259999999538081e-06 | PASS |