Input 06-octopus_basics-periodic_systems.02-silicon_converged.inp
Commits >
Commit 6099f031302cffa2938f492784ba2f7b55faffa3 >
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 | -7.935486720000000e+00 | -7.935486750000001e+00 | 3.970000000000000e-07 | 3.000000070585429e-08 | PASS |