Positions and magnetic moments of all atoms in unit cell, with magnetic moment relations explicitly given:
Magnetic atoms:
Set of atoms in the unit cell related by symmetry with the magnetic atom Ni1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.00000 | 0.00000 | 0.50000 | mx,my,mz | 0.00000 | 1.40000 | 0.00000 |
2 | 0.50000 | 0.50000 | 0.00000 | -mx,my,-mz | 0.00000 | 1.40000 | 0.00000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Ir1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.00000 | 0.00000 | 0.00000 | mx,my,mz | 0.00000 | 0.00000 | 1.60000 |
2 | 0.50000 | 0.50000 | 0.50000 | -mx,my,-mz | 0.00000 | 0.00000 | -1.60000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Nd1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.98580 | 0.43843 | 0.25020 | mx,my,mz | 0.98000 | 0.40000 | 0.38000 |
2 | 0.51420 | 0.93843 | 0.24980 | -mx,my,-mz | -0.98000 | 0.40000 | -0.38000 |
3 | 0.01420 | 0.56157 | 0.74980 | mx,my,mz | 0.98000 | 0.40000 | 0.38000 |
4 | 0.48580 | 0.06157 | 0.75020 | -mx,my,-mz | -0.98000 | 0.40000 | -0.38000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom Ir2:
Atom | x | y | z |
1 | 0.00000 | 0.00000 | 0.50000 |
2 | 0.50000 | 0.50000 | 0.00000 |
Set of atoms in the unit cell related by symmetry with the atom Ni2:
Atom | x | y | z |
1 | 0.00000 | 0.00000 | 0.00000 |
2 | 0.50000 | 0.50000 | 0.50000 |
Set of atoms in the unit cell related by symmetry with the atom O1:
Atom | x | y | z |
1 | 0.09770 | 0.02790 | 0.24600 |
2 | 0.40230 | 0.52790 | 0.25400 |
3 | 0.90230 | 0.97210 | 0.75400 |
4 | 0.59770 | 0.47210 | 0.74600 |
Set of atoms in the unit cell related by symmetry with the atom O2:
Atom | x | y | z |
1 | 0.19300 | 0.30570 | 0.96180 |
2 | 0.30700 | 0.80570 | 0.53820 |
3 | 0.80700 | 0.69430 | 0.03820 |
4 | 0.69300 | 0.19430 | 0.46180 |
Set of atoms in the unit cell related by symmetry with the atom O3:
Atom | x | y | z |
1 | 0.29900 | 0.79280 | 0.94160 |
2 | 0.20100 | 0.29280 | 0.55840 |
3 | 0.70100 | 0.20720 | 0.05840 |
4 | 0.79900 | 0.70720 | 0.44160 |
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