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 Cu1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.12500 | 0.12500 | 0.12500 | mx,my,0 | -0.85000 | 0.00000 | 0.00000 |
2 | 0.87500 | 0.87500 | 0.87500 | mx,my,0 | -0.85000 | 0.00000 | 0.00000 |
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3 | 0.12500 | 0.62500 | 0.62500 | mx,my,0 | -0.85000 | 0.00000 | 0.00000 |
4 | 0.87500 | 0.37500 | 0.37500 | mx,my,0 | -0.85000 | 0.00000 | 0.00000 |
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5 | 0.62500 | 0.12500 | 0.62500 | mx,my,0 | -0.85000 | 0.00000 | 0.00000 |
6 | 0.37500 | 0.87500 | 0.37500 | mx,my,0 | -0.85000 | 0.00000 | 0.00000 |
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7 | 0.62500 | 0.62500 | 0.12500 | mx,my,0 | -0.85000 | 0.00000 | 0.00000 |
8 | 0.37500 | 0.37500 | 0.87500 | mx,my,0 | -0.85000 | 0.00000 | 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,my,mz | 1.60000 | 0.00000 | 2.07000 |
2 | 0.75000 | 0.75000 | 0.50000 | mx,my,-mz | 1.60000 | 0.00000 | -2.07000 |
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3 | 0.50000 | 0.00000 | 0.00000 | mx,my,mz | 1.60000 | 0.00000 | 2.07000 |
4 | 0.75000 | 0.25000 | 0.00000 | mx,my,-mz | 1.60000 | 0.00000 | -2.07000 |
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5 | 0.00000 | 0.50000 | 0.00000 | mx,my,mz | 1.60000 | 0.00000 | 2.07000 |
6 | 0.25000 | 0.75000 | 0.00000 | mx,my,-mz | 1.60000 | 0.00000 | -2.07000 |
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7 | 0.00000 | 0.00000 | 0.50000 | mx,my,mz | 1.60000 | 0.00000 | 2.07000 |
8 | 0.25000 | 0.25000 | 0.50000 | mx,my,-mz | 1.60000 | 0.00000 | -2.07000 |
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 | 0.25000 | 0.50000 | 0.25000 | mx,my,mz | 1.60000 | 0.00000 | -2.07000 |
2 | 0.00000 | 0.75000 | 0.25000 | mx,my,-mz | 1.60000 | 0.00000 | 2.07000 |
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3 | 0.25000 | 0.00000 | 0.75000 | mx,my,mz | 1.60000 | 0.00000 | -2.07000 |
4 | 0.00000 | 0.25000 | 0.75000 | mx,my,-mz | 1.60000 | 0.00000 | 2.07000 |
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5 | 0.75000 | 0.50000 | 0.75000 | mx,my,mz | 1.60000 | 0.00000 | -2.07000 |
6 | 0.50000 | 0.75000 | 0.75000 | mx,my,-mz | 1.60000 | 0.00000 | 2.07000 |
(1/2,1/2,0) + set click here to show and hide |
7 | 0.75000 | 0.00000 | 0.25000 | mx,my,mz | 1.60000 | 0.00000 | -2.07000 |
8 | 0.50000 | 0.25000 | 0.25000 | mx,my,-mz | 1.60000 | 0.00000 | 2.07000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom O1_1:
Atom | x | y | z |
1 | 0.24530 | 0.26800 | 0.26800 |
2 | 0.75470 | 0.73200 | 0.73200 |
3 | 0.00470 | 0.98200 | 0.26800 |
4 | 0.49530 | 0.51800 | 0.73200 |
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5 | 0.24530 | 0.76800 | 0.76800 |
6 | 0.75470 | 0.23200 | 0.23200 |
7 | 0.00470 | 0.48200 | 0.76800 |
8 | 0.49530 | 0.01800 | 0.23200 |
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9 | 0.74530 | 0.26800 | 0.76800 |
10 | 0.25470 | 0.73200 | 0.23200 |
11 | 0.50470 | 0.98200 | 0.76800 |
12 | 0.99530 | 0.51800 | 0.23200 |
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13 | 0.74530 | 0.76800 | 0.26800 |
14 | 0.25470 | 0.23200 | 0.73200 |
15 | 0.50470 | 0.48200 | 0.26800 |
16 | 0.99530 | 0.01800 | 0.73200 |
Set of atoms in the unit cell related by symmetry with the atom O1_2:
Atom | x | y | z |
1 | 0.24530 | 0.98200 | 0.98200 |
2 | 0.75470 | 0.01800 | 0.01800 |
3 | 0.00470 | 0.26800 | 0.98200 |
4 | 0.49530 | 0.23200 | 0.01800 |
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5 | 0.24530 | 0.48200 | 0.48200 |
6 | 0.75470 | 0.51800 | 0.51800 |
7 | 0.00470 | 0.76800 | 0.48200 |
8 | 0.49530 | 0.73200 | 0.51800 |
(1/2,0,1/2) + set click here to show and hide |
9 | 0.74530 | 0.98200 | 0.48200 |
10 | 0.25470 | 0.01800 | 0.51800 |
11 | 0.50470 | 0.26800 | 0.48200 |
12 | 0.99530 | 0.23200 | 0.51800 |
(1/2,1/2,0) + set click here to show and hide |
13 | 0.74530 | 0.48200 | 0.98200 |
14 | 0.25470 | 0.51800 | 0.01800 |
15 | 0.50470 | 0.76800 | 0.98200 |
16 | 0.99530 | 0.73200 | 0.01800 |
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