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 Mn1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.12500 | 0.12500 | 0.12500 | mx,-mx,0 | -2.06000 | 2.06000 | 0.00000 |
2 | 0.37500 | 0.37500 | 0.87500 | mx,-mx,0 | -2.06000 | 2.06000 | 0.00000 |
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3 | 0.62500 | 0.12500 | 0.62500 | mx,-mx,0 | -2.06000 | 2.06000 | 0.00000 |
4 | 0.87500 | 0.37500 | 0.37500 | mx,-mx,0 | -2.06000 | 2.06000 | 0.00000 |
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5 | 0.62500 | 0.62500 | 0.12500 | mx,-mx,0 | -2.06000 | 2.06000 | 0.00000 |
6 | 0.87500 | 0.87500 | 0.87500 | mx,-mx,0 | -2.06000 | 2.06000 | 0.00000 |
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7 | 0.12500 | 0.62500 | 0.62500 | mx,-mx,0 | -2.06000 | 2.06000 | 0.00000 |
8 | 0.37500 | 0.87500 | 0.37500 | mx,-mx,0 | -2.06000 | 2.06000 | 0.00000 |
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 | 0.50000 | 0.50000 | 0.50000 | mx,-mx,mz | 0.90000 | -0.90000 | 0.00000 |
2 | 0.75000 | 0.75000 | 0.50000 | mx,-mx,mz | 0.90000 | -0.90000 | 0.00000 |
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3 | 0.00000 | 0.50000 | 0.00000 | mx,-mx,mz | 0.90000 | -0.90000 | 0.00000 |
4 | 0.25000 | 0.75000 | 0.00000 | mx,-mx,mz | 0.90000 | -0.90000 | 0.00000 |
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5 | 0.00000 | 0.00000 | 0.50000 | mx,-mx,mz | 0.90000 | -0.90000 | 0.00000 |
6 | 0.25000 | 0.25000 | 0.50000 | mx,-mx,mz | 0.90000 | -0.90000 | 0.00000 |
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7 | 0.50000 | 0.00000 | 0.00000 | mx,-mx,mz | 0.90000 | -0.90000 | 0.00000 |
8 | 0.75000 | 0.25000 | 0.00000 | mx,-mx,mz | 0.90000 | -0.90000 | 0.00000 |
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 | 0.75000 | 0.00000 | 0.25000 | mx,-mx,0 | 0.72000 | -0.72000 | 0.00000 |
2 | 0.00000 | 0.75000 | 0.25000 | mx,-mx,0 | 0.72000 | -0.72000 | 0.00000 |
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3 | 0.25000 | 0.00000 | 0.75000 | mx,-mx,0 | 0.72000 | -0.72000 | 0.00000 |
4 | 0.50000 | 0.75000 | 0.75000 | mx,-mx,0 | 0.72000 | -0.72000 | 0.00000 |
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5 | 0.25000 | 0.50000 | 0.25000 | mx,-mx,0 | 0.72000 | -0.72000 | 0.00000 |
6 | 0.50000 | 0.25000 | 0.25000 | mx,-mx,0 | 0.72000 | -0.72000 | 0.00000 |
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7 | 0.75000 | 0.50000 | 0.75000 | mx,-mx,0 | 0.72000 | -0.72000 | 0.00000 |
8 | 0.00000 | 0.25000 | 0.75000 | mx,-mx,0 | 0.72000 | -0.72000 | 0.00000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom O1_1:
Atom | x | y | z |
1 | 0.73616 | 0.73616 | 0.73616 |
2 | 0.51384 | 0.51384 | 0.73616 |
3 | 0.98616 | 0.98616 | 0.26384 |
4 | 0.26384 | 0.26384 | 0.26384 |
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5 | 0.23616 | 0.73616 | 0.23616 |
6 | 0.01384 | 0.51384 | 0.23616 |
7 | 0.48616 | 0.98616 | 0.76384 |
8 | 0.76384 | 0.26384 | 0.76384 |
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9 | 0.23616 | 0.23616 | 0.73616 |
10 | 0.01384 | 0.01384 | 0.73616 |
11 | 0.48616 | 0.48616 | 0.26384 |
12 | 0.76384 | 0.76384 | 0.26384 |
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13 | 0.73616 | 0.23616 | 0.23616 |
14 | 0.51384 | 0.01384 | 0.23616 |
15 | 0.98616 | 0.48616 | 0.76384 |
16 | 0.26384 | 0.76384 | 0.76384 |
Set of atoms in the unit cell related by symmetry with the atom O1_2:
Atom | x | y | z |
1 | 0.51384 | 0.23616 | 0.01384 |
2 | 0.23616 | 0.51384 | 0.01384 |
3 | 0.76384 | 0.48616 | 0.98616 |
4 | 0.48616 | 0.76384 | 0.98616 |
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5 | 0.01384 | 0.23616 | 0.51384 |
6 | 0.73616 | 0.51384 | 0.51384 |
7 | 0.26384 | 0.48616 | 0.48616 |
8 | 0.98616 | 0.76384 | 0.48616 |
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9 | 0.01384 | 0.73616 | 0.01384 |
10 | 0.73616 | 0.01384 | 0.01384 |
11 | 0.26384 | 0.98616 | 0.98616 |
12 | 0.98616 | 0.26384 | 0.98616 |
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13 | 0.51384 | 0.73616 | 0.51384 |
14 | 0.23616 | 0.01384 | 0.51384 |
15 | 0.76384 | 0.98616 | 0.48616 |
16 | 0.48616 | 0.26384 | 0.48616 |
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