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 Cr1_1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.00000 | 0.00000 | 0.50000 | mx,my,mz | -1.28000 | 0.00000 | 3.12000 |
2 | 0.00000 | 0.50000 | 0.50000 | -mx,my,-mz | 1.28000 | 0.00000 | -3.12000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Cr1_2:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.50000 | 0.00000 | 0.00000 | mx,my,mz | 1.28000 | 0.00000 | -3.12000 |
2 | 0.50000 | 0.50000 | 0.00000 | -mx,my,-mz | -1.28000 | 0.00000 | 3.12000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Fe1_1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.00000 | 0.00000 | 0.50000 | mx,my,mz | -1.28000 | 0.00000 | 3.12000 |
2 | 0.00000 | 0.50000 | 0.50000 | -mx,my,-mz | 1.28000 | 0.00000 | -3.12000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Fe1_2:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.50000 | 0.00000 | 0.00000 | mx,my,mz | 1.28000 | 0.00000 | -3.12000 |
2 | 0.50000 | 0.50000 | 0.00000 | -mx,my,-mz | -1.28000 | 0.00000 | 3.12000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom Y1_1:
Atom | x | y | z |
1 | 0.06820 | 0.25000 | 0.98220 |
2 | 0.93180 | 0.75000 | 0.01780 |
Set of atoms in the unit cell related by symmetry with the atom Y1_2:
Atom | x | y | z |
1 | 0.43180 | 0.75000 | 0.48220 |
2 | 0.56820 | 0.25000 | 0.51780 |
Set of atoms in the unit cell related by symmetry with the atom O1_1:
Atom | x | y | z |
1 | 0.46170 | 0.25000 | 0.10870 |
2 | 0.53830 | 0.75000 | 0.89130 |
Set of atoms in the unit cell related by symmetry with the atom O1_2:
Atom | x | y | z |
1 | 0.03830 | 0.75000 | 0.60870 |
2 | 0.96170 | 0.25000 | 0.39130 |
Set of atoms in the unit cell related by symmetry with the atom O2_1:
Atom | x | y | z |
1 | 0.30270 | 0.05570 | 0.69240 |
2 | 0.69730 | 0.55570 | 0.30760 |
3 | 0.69730 | 0.94430 | 0.30760 |
4 | 0.30270 | 0.44430 | 0.69240 |
Set of atoms in the unit cell related by symmetry with the atom O2_2:
Atom | x | y | z |
1 | 0.19730 | 0.94430 | 0.19240 |
2 | 0.80270 | 0.44430 | 0.80760 |
3 | 0.80270 | 0.05570 | 0.80760 |
4 | 0.19730 | 0.55570 | 0.19240 |
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