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 Fe:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.00000 | 0.00000 | 0.00000 | mx,my,0 | 2.20000 | 0.00000 | 0.00000 |
2 | 0.50000 | 0.00000 | 0.00000 | -mx,my,0 | -2.20000 | 0.00000 | 0.00000 |
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3 | 0.50000 | 0.50000 | 0.50000 | mx,my,0 | 2.20000 | 0.00000 | 0.00000 |
4 | 0.00000 | 0.50000 | 0.50000 | -mx,my,0 | -2.20000 | 0.00000 | 0.00000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Sc:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.00000 | 0.00000 | 0.00000 | mx,my,0 | 2.20000 | 0.00000 | 0.00000 |
2 | 0.50000 | 0.00000 | 0.00000 | -mx,my,0 | -2.20000 | 0.00000 | 0.00000 |
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3 | 0.50000 | 0.50000 | 0.50000 | mx,my,0 | 2.20000 | 0.00000 | 0.00000 |
4 | 0.00000 | 0.50000 | 0.50000 | -mx,my,0 | -2.20000 | 0.00000 | 0.00000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom Bi:
Atom | x | y | z |
1 | 0.25000 | 0.52000 | 0.92520 |
2 | 0.75000 | 0.48000 | 0.92520 |
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3 | 0.75000 | 0.02000 | 0.42520 |
4 | 0.25000 | 0.98000 | 0.42520 |
Set of atoms in the unit cell related by symmetry with the atom O1:
Atom | x | y | z |
1 | 0.04720 | 0.76870 | 0.28550 |
2 | 0.54720 | 0.23130 | 0.28550 |
3 | 0.95280 | 0.23130 | 0.28550 |
4 | 0.45280 | 0.76870 | 0.28550 |
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5 | 0.54720 | 0.26870 | 0.78550 |
6 | 0.04720 | 0.73130 | 0.78550 |
7 | 0.45280 | 0.73130 | 0.78550 |
8 | 0.95280 | 0.26870 | 0.78550 |
Set of atoms in the unit cell related by symmetry with the atom O2:
Atom | x | y | z |
1 | 0.25000 | 0.07260 | 0.06520 |
2 | 0.75000 | 0.92740 | 0.06520 |
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3 | 0.75000 | 0.57260 | 0.56520 |
4 | 0.25000 | 0.42740 | 0.56520 |
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