Input 01-quadratic_box.01-ground_state.inp
Commits >
Commit 3874475d54e6d4931162c1a62f5667add8f8f561 >
Run foss_cuda_autotools: [foss2022a-cuda-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| SCF convergence | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| Eigenvalue | 9.999209999999999e-01 | 9.999209999999999e-01 | 5.000000000000000e-05 | 0.000000000000000e+00 | PASS |
| Occupation | 1.000000000000000e+00 | 1.000000000000000e+00 | 5.000000000000000e-05 | 0.000000000000000e+00 | PASS |