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 Fe1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.11470 | 0.25000 | 0.19360 | mx,0,mz | 4.06000 | 0.00000 | 0.00000 |
2 | 0.61470 | 0.25000 | 0.30640 | mx,0,-mz | 4.06000 | 0.00000 | 0.00000 |
3 | 0.88530 | 0.75000 | 0.80640 | -mx,0,-mz | -4.06000 | 0.00000 | 0.00000 |
4 | 0.38530 | 0.75000 | 0.69360 | -mx,0,mz | -4.06000 | 0.00000 | 0.00000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom Rb1:
Atom | x | y | z |
1 | 0.35660 | 0.49920 | 0.15990 |
2 | 0.85660 | 0.00080 | 0.34010 |
3 | 0.64340 | 0.99920 | 0.84010 |
4 | 0.14340 | 0.50080 | 0.65990 |
5 | 0.64340 | 0.50080 | 0.84010 |
6 | 0.14340 | 0.99920 | 0.65990 |
7 | 0.35660 | 0.00080 | 0.15990 |
8 | 0.85660 | 0.49920 | 0.34010 |
Set of atoms in the unit cell related by symmetry with the atom Cl1:
Atom | x | y | z |
1 | 0.24640 | 0.25000 | 0.40230 |
2 | 0.74640 | 0.25000 | 0.09770 |
3 | 0.75360 | 0.75000 | 0.59770 |
4 | 0.25360 | 0.75000 | 0.90230 |
Set of atoms in the unit cell related by symmetry with the atom Cl2:
Atom | x | y | z |
1 | 0.22380 | 0.25000 | 0.93350 |
2 | 0.72380 | 0.25000 | 0.56650 |
3 | 0.77620 | 0.75000 | 0.06650 |
4 | 0.27620 | 0.75000 | 0.43350 |
Set of atoms in the unit cell related by symmetry with the atom Cl3:
Atom | x | y | z |
1 | 0.00660 | 0.25000 | 0.46220 |
2 | 0.50660 | 0.25000 | 0.03780 |
3 | 0.99340 | 0.75000 | 0.53780 |
4 | 0.49340 | 0.75000 | 0.96220 |
Set of atoms in the unit cell related by symmetry with the atom Cl4:
Atom | x | y | z |
1 | 0.10320 | 0.49070 | 0.17940 |
2 | 0.60320 | 0.00930 | 0.32060 |
3 | 0.89680 | 0.99070 | 0.82060 |
4 | 0.39680 | 0.50930 | 0.67940 |
5 | 0.89680 | 0.50930 | 0.82060 |
6 | 0.39680 | 0.99070 | 0.67940 |
7 | 0.10320 | 0.00930 | 0.17940 |
8 | 0.60320 | 0.49070 | 0.32060 |
Set of atoms in the unit cell related by symmetry with the atom O1:
Atom | x | y | z |
1 | 0.99860 | 0.25000 | 0.01220 |
2 | 0.49860 | 0.25000 | 0.48780 |
3 | 0.00140 | 0.75000 | 0.98780 |
4 | 0.50140 | 0.75000 | 0.51220 |
Set of atoms in the unit cell related by symmetry with the atom D1:
Atom | x | y | z |
1 | 0.96590 | 0.32970 | 0.95210 |
2 | 0.46590 | 0.17030 | 0.54790 |
3 | 0.03410 | 0.82970 | 0.04790 |
4 | 0.53410 | 0.67030 | 0.45210 |
5 | 0.03410 | 0.67030 | 0.04790 |
6 | 0.53410 | 0.82970 | 0.45210 |
7 | 0.96590 | 0.17030 | 0.95210 |
8 | 0.46590 | 0.32970 | 0.54790 |
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