Input 08-constrain.02-gs_dir.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 | 5.100000000000000e-05 | 0.000000000000000e+00 | PASS |
| Total Magnetic Moment - x | 0.000000000000000e+00 | 0.000000000000000e+00 | 5.100000000000000e-05 | 0.000000000000000e+00 | PASS |
| Total Magnetic Moment - y | 1.000000000000000e+00 | 1.000000000000000e+00 | 5.100000000000000e-05 | 0.000000000000000e+00 | PASS |
| Total Magnetic Moment - z | 0.000000000000000e+00 | 0.000000000000000e+00 | 5.100000000000000e-05 | 0.000000000000000e+00 | PASS |