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 | 0.56925 | 0.64487 | 0.05364 | mx,my,mz | 0.50000 | 0.78000 | 2.90000 |
2 | 0.35513 | 0.92438 | 0.05364 | -my,mx-my,mz | -0.78000 | -0.28000 | 2.90000 |
3 | 0.07562 | 0.43075 | 0.05364 | -mx+my,-mx,mz | 0.28000 | -0.50000 | 2.90000 |
4 | 0.07562 | 0.64487 | 0.05364 | mx-my,-my,-mz | -0.28000 | -0.78000 | -2.90000 |
5 | 0.35513 | 0.43075 | 0.05364 | my,mx,-mz | 0.78000 | 0.50000 | -2.90000 |
6 | 0.56925 | 0.92438 | 0.05364 | -mx,-mx+my,-mz | -0.50000 | 0.28000 | -2.90000 |
7 | 0.92438 | 0.56925 | 0.55364 | -mx+my,-mx,-mz | 0.28000 | -0.50000 | -2.90000 |
8 | 0.43075 | 0.35513 | 0.55364 | mx,my,-mz | 0.50000 | 0.78000 | -2.90000 |
9 | 0.64487 | 0.07562 | 0.55364 | -my,mx-my,-mz | -0.78000 | -0.28000 | -2.90000 |
10 | 0.43075 | 0.07562 | 0.55364 | -mx,-mx+my,mz | -0.50000 | 0.28000 | 2.90000 |
11 | 0.92438 | 0.35513 | 0.55364 | mx-my,-my,mz | -0.28000 | -0.78000 | 2.90000 |
12 | 0.64487 | 0.56925 | 0.55364 | my,mx,mz | 0.78000 | 0.50000 | 2.90000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom Te1:
Atom | x | y | z |
1 | 0.85518 | 0.14482 | 0.00000 |
2 | 0.85518 | 0.71036 | 0.00000 |
3 | 0.28964 | 0.14482 | 0.00000 |
4 | 0.71036 | 0.85518 | 0.50000 |
5 | 0.14482 | 0.85518 | 0.50000 |
6 | 0.14482 | 0.28964 | 0.50000 |
Set of atoms in the unit cell related by symmetry with the atom Te2:
Atom | x | y | z |
1 | 0.33333 | 0.66667 | 0.09040 |
2 | 0.66666 | 0.33333 | 0.59040 |
Set of atoms in the unit cell related by symmetry with the atom O1:
Atom | x | y | z |
1 | 0.79163 | 0.20837 | 0.76080 |
2 | 0.79163 | 0.58326 | 0.76080 |
3 | 0.41674 | 0.20837 | 0.76080 |
4 | 0.58326 | 0.79163 | 0.26080 |
5 | 0.20837 | 0.79163 | 0.26080 |
6 | 0.20837 | 0.41674 | 0.26080 |
Set of atoms in the unit cell related by symmetry with the atom O2:
Atom | x | y | z |
1 | 0.66570 | 0.94120 | 0.71930 |
2 | 0.05880 | 0.72450 | 0.71930 |
3 | 0.27550 | 0.33430 | 0.71930 |
4 | 0.27550 | 0.94120 | 0.71930 |
5 | 0.05880 | 0.33430 | 0.71930 |
6 | 0.66570 | 0.72450 | 0.71930 |
7 | 0.72450 | 0.66570 | 0.21930 |
8 | 0.33430 | 0.05880 | 0.21930 |
9 | 0.94120 | 0.27550 | 0.21930 |
10 | 0.33430 | 0.27550 | 0.21930 |
11 | 0.72450 | 0.05880 | 0.21930 |
12 | 0.94120 | 0.66570 | 0.21930 |
Set of atoms in the unit cell related by symmetry with the atom O3:
Atom | x | y | z |
1 | 0.59584 | 0.40416 | 0.40500 |
2 | 0.59584 | 0.19168 | 0.40500 |
3 | 0.80832 | 0.40416 | 0.40500 |
4 | 0.19168 | 0.59584 | 0.90500 |
5 | 0.40416 | 0.59584 | 0.90500 |
6 | 0.40416 | 0.80832 | 0.90500 |
Set of atoms in the unit cell related by symmetry with the atom O4:
Atom | x | y | z |
1 | 0.52617 | 0.47383 | 0.87520 |
2 | 0.52617 | 0.05234 | 0.87520 |
3 | 0.94766 | 0.47383 | 0.87520 |
4 | 0.05234 | 0.52617 | 0.37520 |
5 | 0.47383 | 0.52617 | 0.37520 |
6 | 0.47383 | 0.94766 | 0.37520 |
Set of atoms in the unit cell related by symmetry with the atom H1:
Atom | x | y | z |
1 | 0.88590 | 0.11410 | 0.00040 |
2 | 0.88590 | 0.77180 | 0.00040 |
3 | 0.22820 | 0.11410 | 0.00040 |
4 | 0.77180 | 0.88590 | 0.50040 |
5 | 0.11410 | 0.88590 | 0.50040 |
6 | 0.11410 | 0.22820 | 0.50040 |
Set of atoms in the unit cell related by symmetry with the atom O5:
Atom | x | y | z |
1 | 0.00000 | 0.00000 | 0.71700 |
2 | 0.00000 | 0.00000 | 0.21700 |
Set of atoms in the unit cell related by symmetry with the atom O6:
Atom | x | y | z |
1 | 0.88050 | 0.94020 | 0.00300 |
2 | 0.05980 | 0.94030 | 0.00300 |
3 | 0.05970 | 0.11950 | 0.00300 |
4 | 0.94030 | 0.88050 | 0.50300 |
5 | 0.11950 | 0.05980 | 0.50300 |
6 | 0.94020 | 0.05970 | 0.50300 |
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