Input 08-constrain.02-gs_dir.inp
Commits >
Commit 4b6d45842a438d46c51308ffa6e74b875e60d9e9 >
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 |