Input 08-constrain.03-polarized.inp
Commits >
Commit b1773e3237a9e3fe1d68ecd7146c17ebbd95a961 >
Run GCI_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 - z | -1.000000000000000e+00 | -1.000000000000000e+00 | 5.100000000000000e-05 | 0.000000000000000e+00 | PASS |