Input 06-octopus_basics-periodic_systems.02-silicon_converged.inp
Commits >
Commit 3874475d54e6d4931162c1a62f5667add8f8f561 >
Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-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 |