Input 05-spin_precession.01-ground_state.inp
Commits >
Commit a207e10cd726e9ee7bae9ea565d18a80e5fdcb20 >
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 |
| Total energy | 2.499999700000000e-01 | 2.499999700000000e-01 | 1.500000000000000e-07 | 0.000000000000000e+00 | PASS |