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 Co3:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.00000 | 0.00000 | 0.11640 | mx,2mx,mz | 1.62000 | 3.24000 | 0.35000 |
2 | 0.00000 | 0.00000 | 0.38360 | -mx,-2mx,-mz | -1.62000 | -3.24000 | -0.35000 |
(1/3,2/3,1/3) + set click here to show and hide |
3 | 0.33333 | 0.66667 | 0.44973 | mx,2mx,mz | 1.62000 | 3.24000 | 0.35000 |
4 | 0.33333 | 0.66667 | 0.71693 | -mx,-2mx,-mz | -1.62000 | -3.24000 | -0.35000 |
(2/3,1/3,2/3) + set click here to show and hide |
5 | 0.66667 | 0.33333 | 0.78307 | mx,2mx,mz | 1.62000 | 3.24000 | 0.35000 |
6 | 0.66667 | 0.33333 | 0.05027 | -mx,-2mx,-mz | -1.62000 | -3.24000 | -0.35000 |
(0,0,1/2)' + set click here to show and hide |
7 | 0.00000 | 0.00000 | 0.61640 | -mx,-2mx,-mz | -1.62000 | -3.24000 | -0.35000 |
8 | 0.00000 | 0.00000 | 0.88360 | mx,2mx,mz | 1.62000 | 3.24000 | 0.35000 |
(1/3,2/3,5/6)' + set click here to show and hide |
9 | 0.33333 | 0.66667 | 0.94973 | -mx,-2mx,-mz | -1.62000 | -3.24000 | -0.35000 |
10 | 0.33333 | 0.66667 | 0.21693 | mx,2mx,mz | 1.62000 | 3.24000 | 0.35000 |
(2/3,1/3,1/6)' + set click here to show and hide |
11 | 0.66667 | 0.33333 | 0.28307 | -mx,-2mx,-mz | -1.62000 | -3.24000 | -0.35000 |
12 | 0.66667 | 0.33333 | 0.55027 | mx,2mx,mz | 1.62000 | 3.24000 | 0.35000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Co5:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.00000 | 0.00000 | 0.00000 | mx,2mx,mz | 1.03000 | 2.06000 | -0.35000 |
(1/3,2/3,1/3) + set click here to show and hide |
2 | 0.33333 | 0.66667 | 0.33333 | mx,2mx,mz | 1.03000 | 2.06000 | -0.35000 |
(2/3,1/3,2/3) + set click here to show and hide |
3 | 0.66667 | 0.33333 | 0.66667 | mx,2mx,mz | 1.03000 | 2.06000 | -0.35000 |
(0,0,1/2)' + set click here to show and hide |
4 | 0.00000 | 0.00000 | 0.50000 | -mx,-2mx,-mz | -1.03000 | -2.06000 | 0.35000 |
(1/3,2/3,5/6)' + set click here to show and hide |
5 | 0.33333 | 0.66667 | 0.83333 | -mx,-2mx,-mz | -1.03000 | -2.06000 | 0.35000 |
(2/3,1/3,1/6)' + set click here to show and hide |
6 | 0.66667 | 0.33333 | 0.16667 | -mx,-2mx,-mz | -1.03000 | -2.06000 | 0.35000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom Co1:
Atom | x | y | z |
1 | 0.00000 | 0.00000 | 0.29420 |
2 | 0.00000 | 0.00000 | 0.20580 |
(1/3,2/3,1/3) + set click here to show and hide |
3 | 0.33333 | 0.66667 | 0.62753 |
4 | 0.33333 | 0.66667 | 0.53913 |
(2/3,1/3,2/3) + set click here to show and hide |
5 | 0.66667 | 0.33333 | 0.96087 |
6 | 0.66667 | 0.33333 | 0.87247 |
(0,0,1/2)' + set click here to show and hide |
7 | 0.00000 | 0.00000 | 0.79420 |
8 | 0.00000 | 0.00000 | 0.70580 |
(1/3,2/3,5/6)' + set click here to show and hide |
9 | 0.33333 | 0.66667 | 0.12753 |
10 | 0.33333 | 0.66667 | 0.03913 |
(2/3,1/3,1/6)' + set click here to show and hide |
11 | 0.66667 | 0.33333 | 0.46087 |
12 | 0.66667 | 0.33333 | 0.37247 |
Set of atoms in the unit cell related by symmetry with the atom Co2:
Atom | x | y | z |
1 | 0.00000 | 0.00000 | 0.25000 |
(1/3,2/3,1/3) + set click here to show and hide |
2 | 0.33333 | 0.66667 | 0.58333 |
(2/3,1/3,2/3) + set click here to show and hide |
3 | 0.66667 | 0.33333 | 0.91667 |
(0,0,1/2)' + set click here to show and hide |
4 | 0.00000 | 0.00000 | 0.75000 |
(1/3,2/3,5/6)' + set click here to show and hide |
5 | 0.33333 | 0.66667 | 0.08333 |
(2/3,1/3,1/6)' + set click here to show and hide |
6 | 0.66667 | 0.33333 | 0.41667 |
Set of atoms in the unit cell related by symmetry with the atom Co4_1:
Atom | x | y | z |
1 | 0.50000 | 0.00000 | 0.00000 |
(1/3,2/3,1/3) + set click here to show and hide |
2 | 0.83333 | 0.66667 | 0.33333 |
(2/3,1/3,2/3) + set click here to show and hide |
3 | 0.16667 | 0.33333 | 0.66667 |
(0,0,1/2)' + set click here to show and hide |
4 | 0.50000 | 0.00000 | 0.50000 |
(1/3,2/3,5/6)' + set click here to show and hide |
5 | 0.83333 | 0.66667 | 0.83333 |
(2/3,1/3,1/6)' + set click here to show and hide |
6 | 0.16667 | 0.33333 | 0.16667 |
Set of atoms in the unit cell related by symmetry with the atom Co4_2:
Atom | x | y | z |
1 | 0.00000 | 0.50000 | 0.00000 |
2 | 0.50000 | 0.50000 | 0.50000 |
(1/3,2/3,1/3) + set click here to show and hide |
3 | 0.33333 | 0.16667 | 0.33333 |
4 | 0.83333 | 0.16667 | 0.83333 |
(2/3,1/3,2/3) + set click here to show and hide |
5 | 0.66667 | 0.83333 | 0.66667 |
6 | 0.16667 | 0.83333 | 0.16667 |
(0,0,1/2)' + set click here to show and hide |
7 | 0.00000 | 0.50000 | 0.50000 |
8 | 0.50000 | 0.50000 | 0.00000 |
(1/3,2/3,5/6)' + set click here to show and hide |
9 | 0.33333 | 0.16667 | 0.83333 |
10 | 0.83333 | 0.16667 | 0.33333 |
(2/3,1/3,1/6)' + set click here to show and hide |
11 | 0.66667 | 0.83333 | 0.16667 |
12 | 0.16667 | 0.83333 | 0.66667 |
Set of atoms in the unit cell related by symmetry with the atom Ba1:
Atom | x | y | z |
1 | 0.00000 | 0.00000 | 0.44175 |
2 | 0.00000 | 0.00000 | 0.05825 |
(1/3,2/3,1/3) + set click here to show and hide |
3 | 0.33333 | 0.66667 | 0.77508 |
4 | 0.33333 | 0.66667 | 0.39158 |
(2/3,1/3,2/3) + set click here to show and hide |
5 | 0.66667 | 0.33333 | 0.10842 |
6 | 0.66667 | 0.33333 | 0.72492 |
(0,0,1/2)' + set click here to show and hide |
7 | 0.00000 | 0.00000 | 0.94175 |
8 | 0.00000 | 0.00000 | 0.55825 |
(1/3,2/3,5/6)' + set click here to show and hide |
9 | 0.33333 | 0.66667 | 0.27508 |
10 | 0.33333 | 0.66667 | 0.89158 |
(2/3,1/3,1/6)' + set click here to show and hide |
11 | 0.66667 | 0.33333 | 0.60842 |
12 | 0.66667 | 0.33333 | 0.22492 |
Set of atoms in the unit cell related by symmetry with the atom O1_1:
Atom | x | y | z |
1 | 0.15060 | 0.84940 | 0.22815 |
2 | 0.30120 | 0.15060 | 0.27185 |
3 | 0.84940 | 0.15060 | 0.77185 |
4 | 0.69880 | 0.84940 | 0.72815 |
(1/3,2/3,1/3) + set click here to show and hide |
5 | 0.48393 | 0.51607 | 0.56148 |
6 | 0.63453 | 0.81727 | 0.60518 |
7 | 0.18273 | 0.81727 | 0.10518 |
8 | 0.03213 | 0.51607 | 0.06148 |
(2/3,1/3,2/3) + set click here to show and hide |
9 | 0.81727 | 0.18273 | 0.89482 |
10 | 0.96787 | 0.48393 | 0.93852 |
11 | 0.51607 | 0.48393 | 0.43852 |
12 | 0.36547 | 0.18273 | 0.39482 |
(0,0,1/2)' + set click here to show and hide |
13 | 0.15060 | 0.84940 | 0.72815 |
14 | 0.30120 | 0.15060 | 0.77185 |
15 | 0.84940 | 0.15060 | 0.27185 |
16 | 0.69880 | 0.84940 | 0.22815 |
(1/3,2/3,5/6)' + set click here to show and hide |
17 | 0.48393 | 0.51607 | 0.06148 |
18 | 0.63453 | 0.81727 | 0.10518 |
19 | 0.18273 | 0.81727 | 0.60518 |
20 | 0.03213 | 0.51607 | 0.56148 |
(2/3,1/3,1/6)' + set click here to show and hide |
21 | 0.81727 | 0.18273 | 0.39482 |
22 | 0.96787 | 0.48393 | 0.43852 |
23 | 0.51607 | 0.48393 | 0.93852 |
24 | 0.36547 | 0.18273 | 0.89482 |
Set of atoms in the unit cell related by symmetry with the atom O1_2:
Atom | x | y | z |
1 | 0.15060 | 0.30120 | 0.22815 |
2 | 0.84940 | 0.69880 | 0.27185 |
(1/3,2/3,1/3) + set click here to show and hide |
3 | 0.48393 | 0.96787 | 0.56148 |
4 | 0.18273 | 0.36547 | 0.60518 |
(2/3,1/3,2/3) + set click here to show and hide |
5 | 0.81727 | 0.63453 | 0.89482 |
6 | 0.51607 | 0.03213 | 0.93852 |
(0,0,1/2)' + set click here to show and hide |
7 | 0.15060 | 0.30120 | 0.72815 |
8 | 0.84940 | 0.69880 | 0.77185 |
(1/3,2/3,5/6)' + set click here to show and hide |
9 | 0.48393 | 0.96787 | 0.06148 |
10 | 0.18273 | 0.36547 | 0.10518 |
(2/3,1/3,1/6)' + set click here to show and hide |
11 | 0.81727 | 0.63453 | 0.39482 |
12 | 0.51607 | 0.03213 | 0.43852 |
Set of atoms in the unit cell related by symmetry with the atom O2:
Atom | x | y | z |
1 | 0.00000 | 0.00000 | 0.34980 |
2 | 0.00000 | 0.00000 | 0.15020 |
(1/3,2/3,1/3) + set click here to show and hide |
3 | 0.33333 | 0.66667 | 0.68313 |
4 | 0.33333 | 0.66667 | 0.48353 |
(2/3,1/3,2/3) + set click here to show and hide |
5 | 0.66667 | 0.33333 | 0.01647 |
6 | 0.66667 | 0.33333 | 0.81687 |
(0,0,1/2)' + set click here to show and hide |
7 | 0.00000 | 0.00000 | 0.84980 |
8 | 0.00000 | 0.00000 | 0.65020 |
(1/3,2/3,5/6)' + set click here to show and hide |
9 | 0.33333 | 0.66667 | 0.18313 |
10 | 0.33333 | 0.66667 | 0.98353 |
(2/3,1/3,1/6)' + set click here to show and hide |
11 | 0.66667 | 0.33333 | 0.51647 |
12 | 0.66667 | 0.33333 | 0.31687 |
Set of atoms in the unit cell related by symmetry with the atom O3_1:
Atom | x | y | z |
1 | 0.48510 | 0.51490 | 0.14770 |
2 | 0.97020 | 0.48510 | 0.35230 |
3 | 0.51490 | 0.48510 | 0.85230 |
4 | 0.02980 | 0.51490 | 0.64770 |
(1/3,2/3,1/3) + set click here to show and hide |
5 | 0.81843 | 0.18157 | 0.48103 |
6 | 0.30353 | 0.15177 | 0.68563 |
7 | 0.84823 | 0.15177 | 0.18563 |
8 | 0.36313 | 0.18157 | 0.98103 |
(2/3,1/3,2/3) + set click here to show and hide |
9 | 0.15177 | 0.84823 | 0.81437 |
10 | 0.63687 | 0.81843 | 0.01897 |
11 | 0.18157 | 0.81843 | 0.51897 |
12 | 0.69647 | 0.84823 | 0.31437 |
(0,0,1/2)' + set click here to show and hide |
13 | 0.48510 | 0.51490 | 0.64770 |
14 | 0.97020 | 0.48510 | 0.85230 |
15 | 0.51490 | 0.48510 | 0.35230 |
16 | 0.02980 | 0.51490 | 0.14770 |
(1/3,2/3,5/6)' + set click here to show and hide |
17 | 0.81843 | 0.18157 | 0.98103 |
18 | 0.30353 | 0.15177 | 0.18563 |
19 | 0.84823 | 0.15177 | 0.68563 |
20 | 0.36313 | 0.18157 | 0.48103 |
(2/3,1/3,1/6)' + set click here to show and hide |
21 | 0.15177 | 0.84823 | 0.31437 |
22 | 0.63687 | 0.81843 | 0.51897 |
23 | 0.18157 | 0.81843 | 0.01897 |
24 | 0.69647 | 0.84823 | 0.81437 |
Set of atoms in the unit cell related by symmetry with the atom O3_2:
Atom | x | y | z |
1 | 0.48510 | 0.97020 | 0.14770 |
2 | 0.51490 | 0.02980 | 0.35230 |
(1/3,2/3,1/3) + set click here to show and hide |
3 | 0.81843 | 0.63687 | 0.48103 |
4 | 0.84823 | 0.69647 | 0.68563 |
(2/3,1/3,2/3) + set click here to show and hide |
5 | 0.15177 | 0.30353 | 0.81437 |
6 | 0.18157 | 0.36313 | 0.01897 |
(0,0,1/2)' + set click here to show and hide |
7 | 0.48510 | 0.97020 | 0.64770 |
8 | 0.51490 | 0.02980 | 0.85230 |
(1/3,2/3,5/6)' + set click here to show and hide |
9 | 0.81843 | 0.63687 | 0.98103 |
10 | 0.84823 | 0.69647 | 0.18563 |
(2/3,1/3,1/6)' + set click here to show and hide |
11 | 0.15177 | 0.30353 | 0.31437 |
12 | 0.18157 | 0.36313 | 0.51897 |
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