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 Co1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.05532 | 0.75000 | 0.73208 | 0,my,0 | 0.00000 | 1.30000 | 0.00000 |
2 | 0.94469 | 0.25000 | 0.26792 | 0,my,0 | 0.00000 | 1.30000 | 0.00000 |
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3 | 0.55532 | 0.75000 | 0.73208 | 0,-my,0 | 0.00000 | -1.30000 | 0.00000 |
4 | 0.44469 | 0.25000 | 0.26792 | 0,-my,0 | 0.00000 | -1.30000 | 0.00000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Co2:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.00000 | 0.00000 | 0.50000 | mx,my,mz | -1.90000 | -3.10000 | 0.50000 |
2 | 0.00000 | 0.50000 | 0.50000 | -mx,my,-mz | 1.90000 | -3.10000 | -0.50000 |
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3 | 0.50000 | 0.00000 | 0.50000 | -mx,-my,-mz | 1.90000 | 3.10000 | -0.50000 |
4 | 0.50000 | 0.50000 | 0.50000 | mx,-my,mz | -1.90000 | 3.10000 | 0.50000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom Cs1:
Atom | x | y | z |
1 | 0.20597 | 0.25000 | 0.29973 |
2 | 0.79403 | 0.75000 | 0.70027 |
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3 | 0.70597 | 0.25000 | 0.29973 |
4 | 0.29403 | 0.75000 | 0.70027 |
Set of atoms in the unit cell related by symmetry with the atom Mo1:
Atom | x | y | z |
1 | 0.43572 | 0.25000 | 0.65061 |
2 | 0.56428 | 0.75000 | 0.34939 |
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3 | 0.93572 | 0.25000 | 0.65061 |
4 | 0.06428 | 0.75000 | 0.34939 |
Set of atoms in the unit cell related by symmetry with the atom Mo2:
Atom | x | y | z |
1 | 0.16038 | 0.25000 | 0.84493 |
2 | 0.83962 | 0.75000 | 0.15507 |
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3 | 0.66038 | 0.25000 | 0.84493 |
4 | 0.33962 | 0.75000 | 0.15507 |
Set of atoms in the unit cell related by symmetry with the atom O1:
Atom | x | y | z |
1 | 0.42750 | 0.25000 | 0.03930 |
2 | 0.57250 | 0.75000 | 0.96070 |
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3 | 0.92750 | 0.25000 | 0.03930 |
4 | 0.07250 | 0.75000 | 0.96070 |
Set of atoms in the unit cell related by symmetry with the atom O2:
Atom | x | y | z |
1 | 0.47905 | 0.25000 | 0.48820 |
2 | 0.52095 | 0.75000 | 0.51180 |
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3 | 0.97905 | 0.25000 | 0.48820 |
4 | 0.02095 | 0.75000 | 0.51180 |
Set of atoms in the unit cell related by symmetry with the atom O3:
Atom | x | y | z |
1 | 0.03395 | 0.50630 | 0.23950 |
2 | 0.96605 | 0.00630 | 0.76050 |
3 | 0.96605 | 0.49370 | 0.76050 |
4 | 0.03395 | 0.99370 | 0.23950 |
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5 | 0.53395 | 0.50630 | 0.23950 |
6 | 0.46605 | 0.00630 | 0.76050 |
7 | 0.46605 | 0.49370 | 0.76050 |
8 | 0.53395 | 0.99370 | 0.23950 |
Set of atoms in the unit cell related by symmetry with the atom O4:
Atom | x | y | z |
1 | 0.14100 | 0.48880 | 0.73400 |
2 | 0.85900 | 0.98880 | 0.26600 |
3 | 0.85900 | 0.51120 | 0.26600 |
4 | 0.14100 | 0.01120 | 0.73400 |
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5 | 0.64100 | 0.48880 | 0.73400 |
6 | 0.35900 | 0.98880 | 0.26600 |
7 | 0.35900 | 0.51120 | 0.26600 |
8 | 0.64100 | 0.01120 | 0.73400 |
Set of atoms in the unit cell related by symmetry with the atom O5:
Atom | x | y | z |
1 | 0.09185 | 0.25000 | 0.98210 |
2 | 0.90815 | 0.75000 | 0.01790 |
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3 | 0.59185 | 0.25000 | 0.98210 |
4 | 0.40815 | 0.75000 | 0.01790 |
Set of atoms in the unit cell related by symmetry with the atom O6:
Atom | x | y | z |
1 | 0.32945 | 0.25000 | 0.60400 |
2 | 0.67055 | 0.75000 | 0.39600 |
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3 | 0.82945 | 0.25000 | 0.60400 |
4 | 0.17055 | 0.75000 | 0.39600 |
Set of atoms in the unit cell related by symmetry with the atom O7:
Atom | x | y | z |
1 | 0.26250 | 0.25000 | 0.93190 |
2 | 0.73750 | 0.75000 | 0.06810 |
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3 | 0.76250 | 0.25000 | 0.93190 |
4 | 0.23750 | 0.75000 | 0.06810 |
Set of atoms in the unit cell related by symmetry with the atom H1:
Atom | x | y | z |
1 | 0.37550 | 0.25000 | 0.98600 |
2 | 0.62450 | 0.75000 | 0.01400 |
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3 | 0.87550 | 0.25000 | 0.98600 |
4 | 0.12450 | 0.75000 | 0.01400 |
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