Input 06-octopus_basics-periodic_systems.02-silicon_converged.inp
Commits >
Commit 0fe8dcc2cda723db7bfa614b73e6eb662c8bbe1e >
Run intel_mpi_omp_autotools: [intel2022a-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
SCF convergence | 1.000000000000000e+00 | 1.000000000000000e+00 | 3.960000000000000e-07 | 0.000000000000000e+00 | PASS |
Total Energy | -7.935487540000000e+00 | -7.935487540000000e+00 | 3.970000000000000e-07 | 8.881784197001252e-16 | PASS |