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:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.22456 | 0.00000 | 0.00000 | mx,0,0 | 1.66000 | 0.00000 | 0.00000 |
2 | 0.00000 | 0.22456 | 0.00000 | 0,mx,0 | 0.00000 | 1.66000 | 0.00000 |
3 | 0.77544 | 0.77544 | 0.00000 | -mx,-mx,0 | -1.66000 | -1.66000 | 0.00000 |
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4 | 0.22456 | 0.00000 | 0.50000 | -mx,0,0 | -1.66000 | 0.00000 | 0.00000 |
5 | 0.00000 | 0.22456 | 0.50000 | 0,-mx,0 | 0.00000 | -1.66000 | 0.00000 |
6 | 0.77544 | 0.77544 | 0.50000 | mx,mx,0 | 1.66000 | 1.66000 | 0.00000 |
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 | 0.22456 | 0.00000 | 0.00000 | mx,0,0 | 1.66000 | 0.00000 | 0.00000 |
2 | 0.00000 | 0.22456 | 0.00000 | 0,mx,0 | 0.00000 | 1.66000 | 0.00000 |
3 | 0.77544 | 0.77544 | 0.00000 | -mx,-mx,0 | -1.66000 | -1.66000 | 0.00000 |
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4 | 0.22456 | 0.00000 | 0.50000 | -mx,0,0 | -1.66000 | 0.00000 | 0.00000 |
5 | 0.00000 | 0.22456 | 0.50000 | 0,-mx,0 | 0.00000 | -1.66000 | 0.00000 |
6 | 0.77544 | 0.77544 | 0.50000 | mx,mx,0 | 1.66000 | 1.66000 | 0.00000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom Cs1:
Atom | x | y | z |
1 | 0.57202 | 0.00000 | 0.25000 |
2 | 0.00000 | 0.57202 | 0.25000 |
3 | 0.42798 | 0.42798 | 0.25000 |
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4 | 0.57202 | 0.00000 | 0.75000 |
5 | 0.00000 | 0.57202 | 0.75000 |
6 | 0.42798 | 0.42798 | 0.75000 |
Set of atoms in the unit cell related by symmetry with the atom F1:
Atom | x | y | z |
1 | 0.83226 | 0.00000 | 0.00000 |
2 | 0.00000 | 0.83226 | 0.00000 |
3 | 0.16774 | 0.16774 | 0.00000 |
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4 | 0.83226 | 0.00000 | 0.50000 |
5 | 0.00000 | 0.83226 | 0.50000 |
6 | 0.16774 | 0.16774 | 0.50000 |
Set of atoms in the unit cell related by symmetry with the atom F2:
Atom | x | y | z |
1 | 0.22024 | 0.00000 | 0.25000 |
2 | 0.00000 | 0.22024 | 0.25000 |
3 | 0.77976 | 0.77976 | 0.25000 |
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4 | 0.22024 | 0.00000 | 0.75000 |
5 | 0.00000 | 0.22024 | 0.75000 |
6 | 0.77976 | 0.77976 | 0.75000 |
Set of atoms in the unit cell related by symmetry with the atom F3:
Atom | x | y | z |
1 | 0.43914 | 0.16142 | 0.00000 |
2 | 0.83858 | 0.27772 | 0.00000 |
3 | 0.72228 | 0.56086 | 0.00000 |
4 | 0.27772 | 0.83858 | 0.00000 |
5 | 0.16142 | 0.43914 | 0.00000 |
6 | 0.56086 | 0.72228 | 0.00000 |
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7 | 0.43914 | 0.16142 | 0.50000 |
8 | 0.83858 | 0.27772 | 0.50000 |
9 | 0.72228 | 0.56086 | 0.50000 |
10 | 0.27772 | 0.83858 | 0.50000 |
11 | 0.16142 | 0.43914 | 0.50000 |
12 | 0.56086 | 0.72228 | 0.50000 |
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