Input 06-octopus_basics-periodic_systems.02-silicon_converged.inp
Commits >
Commit 968a3ff7080ffa1f89f08d37efc7416527769dec >
Run foss_cmake: [foss2022a-mpi, foss-min-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 | -7.935486780000000e+00 | -7.935486750000001e+00 | 3.970000000000000e-07 | -2.999999892949745e-08 | PASS |