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 | 0.12500 | 0.12500 | 0.12500 | mx,mx,mz | 0.40000 | 0.40000 | 0.40000 |
2 | 0.87500 | 0.87500 | 0.12500 | -mx,-mx,mz | -0.40000 | -0.40000 | 0.40000 |
3 | 0.12500 | 0.87500 | 0.87500 | -mx,mx,mz | -0.40000 | 0.40000 | 0.40000 |
4 | 0.87500 | 0.12500 | 0.87500 | mx,-mx,mz | 0.40000 | -0.40000 | 0.40000 |
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 | 0.87500 | 0.37500 | 0.62500 | mx,my,mz | -0.40000 | 0.40000 | -0.40000 |
2 | 0.12500 | 0.62500 | 0.62500 | -mx,-my,mz | 0.40000 | -0.40000 | -0.40000 |
3 | 0.37500 | 0.12500 | 0.37500 | -my,mx,mz | -0.40000 | -0.40000 | -0.40000 |
4 | 0.62500 | 0.87500 | 0.37500 | my,-mx,mz | 0.40000 | 0.40000 | -0.40000 |
5 | 0.87500 | 0.62500 | 0.37500 | -mx,my,mz | 0.40000 | 0.40000 | -0.40000 |
6 | 0.12500 | 0.37500 | 0.37500 | mx,-my,mz | -0.40000 | -0.40000 | -0.40000 |
7 | 0.62500 | 0.12500 | 0.62500 | -my,-mx,mz | -0.40000 | 0.40000 | -0.40000 |
8 | 0.37500 | 0.87500 | 0.62500 | my,mx,mz | 0.40000 | -0.40000 | -0.40000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Cr1_3:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.37500 | 0.62500 | 0.87500 | mx,-mx,mz | -0.40000 | 0.40000 | 0.40000 |
2 | 0.62500 | 0.37500 | 0.87500 | -mx,mx,mz | 0.40000 | -0.40000 | 0.40000 |
3 | 0.62500 | 0.62500 | 0.12500 | mx,mx,mz | -0.40000 | -0.40000 | 0.40000 |
4 | 0.37500 | 0.37500 | 0.12500 | -mx,-mx,mz | 0.40000 | 0.40000 | 0.40000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom Mg1_1:
Atom | x | y | z |
1 | 0.25000 | 0.25000 | 0.25000 |
2 | 0.75000 | 0.75000 | 0.25000 |
3 | 0.25000 | 0.75000 | 0.75000 |
4 | 0.75000 | 0.25000 | 0.75000 |
Set of atoms in the unit cell related by symmetry with the atom Mg1_2:
Atom | x | y | z |
1 | 0.00000 | 0.50000 | 0.50000 |
2 | 0.50000 | 0.00000 | 0.50000 |
Set of atoms in the unit cell related by symmetry with the atom Mg1_3:
Atom | x | y | z |
1 | 0.00000 | 0.00000 | 0.00000 |
Set of atoms in the unit cell related by symmetry with the atom Mg1_4:
Atom | x | y | z |
1 | 0.50000 | 0.50000 | 0.00000 |
Set of atoms in the unit cell related by symmetry with the atom O1_1:
Atom | x | y | z |
1 | 0.38900 | 0.38900 | 0.38900 |
2 | 0.61100 | 0.61100 | 0.38900 |
3 | 0.38900 | 0.61100 | 0.61100 |
4 | 0.61100 | 0.38900 | 0.61100 |
Set of atoms in the unit cell related by symmetry with the atom O1_2:
Atom | x | y | z |
1 | 0.61100 | 0.11100 | 0.88900 |
2 | 0.38900 | 0.88900 | 0.88900 |
3 | 0.11100 | 0.38900 | 0.11100 |
4 | 0.88900 | 0.61100 | 0.11100 |
5 | 0.61100 | 0.88900 | 0.11100 |
6 | 0.38900 | 0.11100 | 0.11100 |
7 | 0.88900 | 0.38900 | 0.88900 |
8 | 0.11100 | 0.61100 | 0.88900 |
Set of atoms in the unit cell related by symmetry with the atom O1_3:
Atom | x | y | z |
1 | 0.11100 | 0.88900 | 0.61100 |
2 | 0.88900 | 0.11100 | 0.61100 |
3 | 0.88900 | 0.88900 | 0.38900 |
4 | 0.11100 | 0.11100 | 0.38900 |
Set of atoms in the unit cell related by symmetry with the atom O1_4:
Atom | x | y | z |
1 | 0.13900 | 0.63900 | 0.36100 |
2 | 0.86100 | 0.36100 | 0.36100 |
3 | 0.63900 | 0.86100 | 0.63900 |
4 | 0.36100 | 0.13900 | 0.63900 |
5 | 0.13900 | 0.36100 | 0.63900 |
6 | 0.86100 | 0.63900 | 0.63900 |
7 | 0.36100 | 0.86100 | 0.36100 |
8 | 0.63900 | 0.13900 | 0.36100 |
Set of atoms in the unit cell related by symmetry with the atom O1_5:
Atom | x | y | z |
1 | 0.86100 | 0.86100 | 0.86100 |
2 | 0.13900 | 0.13900 | 0.86100 |
3 | 0.86100 | 0.13900 | 0.13900 |
4 | 0.13900 | 0.86100 | 0.13900 |
Set of atoms in the unit cell related by symmetry with the atom O1_6:
Atom | x | y | z |
1 | 0.63900 | 0.36100 | 0.13900 |
2 | 0.36100 | 0.63900 | 0.13900 |
3 | 0.36100 | 0.36100 | 0.86100 |
4 | 0.63900 | 0.63900 | 0.86100 |
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