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 Fe1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.50000 | 0.23850 | 0.11660 | mx,my,mz | 1.82000 | 0.00000 | 3.94000 |
2 | 0.50000 | 0.76150 | 0.88340 | mx,my,mz | 1.82000 | 0.00000 | 3.94000 |
3 | 0.50000 | 0.76150 | 0.61660 | mx,my,-mz | 1.82000 | 0.00000 | -3.94000 |
4 | 0.50000 | 0.23850 | 0.38340 | mx,my,-mz | 1.82000 | 0.00000 | -3.94000 |
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5 | 0.00000 | 0.73850 | 0.11660 | mx,my,mz | 1.82000 | 0.00000 | 3.94000 |
6 | 0.00000 | 0.26150 | 0.88340 | mx,my,mz | 1.82000 | 0.00000 | 3.94000 |
7 | 0.00000 | 0.26150 | 0.61660 | mx,my,-mz | 1.82000 | 0.00000 | -3.94000 |
8 | 0.00000 | 0.73850 | 0.38340 | mx,my,-mz | 1.82000 | 0.00000 | -3.94000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Fe2:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.00000 | 0.00000 | 0.00000 | mx,my,mz | 0.00000 | 0.00000 | -3.31000 |
2 | 0.00000 | 0.00000 | 0.50000 | mx,my,-mz | 0.00000 | 0.00000 | 3.31000 |
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3 | 0.50000 | 0.50000 | 0.00000 | mx,my,mz | 0.00000 | 0.00000 | -3.31000 |
4 | 0.50000 | 0.50000 | 0.50000 | mx,my,-mz | 0.00000 | 0.00000 | 3.31000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Fe3:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.00000 | 0.49300 | 0.25000 | mx,my,0 | -2.56000 | 0.00000 | 0.00000 |
2 | 0.00000 | 0.50700 | 0.75000 | mx,my,0 | -2.56000 | 0.00000 | 0.00000 |
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3 | 0.50000 | 0.99300 | 0.25000 | mx,my,0 | -2.56000 | 0.00000 | 0.00000 |
4 | 0.50000 | 0.00700 | 0.75000 | mx,my,0 | -2.56000 | 0.00000 | 0.00000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom Co2:
Atom | x | y | z |
1 | 0.00000 | 0.00000 | 0.00000 |
2 | 0.00000 | 0.00000 | 0.50000 |
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3 | 0.50000 | 0.50000 | 0.00000 |
4 | 0.50000 | 0.50000 | 0.50000 |
Set of atoms in the unit cell related by symmetry with the atom Co3:
Atom | x | y | z |
1 | 0.00000 | 0.49300 | 0.25000 |
2 | 0.00000 | 0.50700 | 0.75000 |
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3 | 0.50000 | 0.99300 | 0.25000 |
4 | 0.50000 | 0.00700 | 0.75000 |
Set of atoms in the unit cell related by symmetry with the atom O1:
Atom | x | y | z |
1 | 0.50000 | 0.34370 | 0.25000 |
2 | 0.50000 | 0.65630 | 0.75000 |
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3 | 0.00000 | 0.84370 | 0.25000 |
4 | 0.00000 | 0.15630 | 0.75000 |
Set of atoms in the unit cell related by symmetry with the atom O2:
Atom | x | y | z |
1 | 0.00000 | 0.36260 | 0.04500 |
2 | 0.00000 | 0.63740 | 0.95500 |
3 | 0.00000 | 0.63740 | 0.54500 |
4 | 0.00000 | 0.36260 | 0.45500 |
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5 | 0.50000 | 0.86260 | 0.04500 |
6 | 0.50000 | 0.13740 | 0.95500 |
7 | 0.50000 | 0.13740 | 0.54500 |
8 | 0.50000 | 0.86260 | 0.45500 |
Set of atoms in the unit cell related by symmetry with the atom O3:
Atom | x | y | z |
1 | 0.00000 | 0.09670 | 0.14360 |
2 | 0.00000 | 0.90330 | 0.85640 |
3 | 0.00000 | 0.90330 | 0.64360 |
4 | 0.00000 | 0.09670 | 0.35640 |
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5 | 0.50000 | 0.59670 | 0.14360 |
6 | 0.50000 | 0.40330 | 0.85640 |
7 | 0.50000 | 0.40330 | 0.64360 |
8 | 0.50000 | 0.59670 | 0.35640 |
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