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 Ni1_1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.50000 | 0.00000 | 0.00000 | mx,mx,mz | -0.65500 | -1.31000 | 1.61900 |
2 | 0.00000 | 0.50000 | 0.00000 | -mx,0,mz | 1.31000 | 0.65500 | 1.61900 |
3 | 0.50000 | 0.50000 | 0.00000 | 0,-mx,mz | -0.65500 | 0.65500 | 1.61900 |
(0,0,1/2)' + set click here to show and hide |
4 | 0.50000 | 0.00000 | 0.50000 | -mx,-mx,-mz | 0.65500 | 1.31000 | -1.61900 |
5 | 0.00000 | 0.50000 | 0.50000 | mx,0,-mz | -1.31000 | -0.65500 | -1.61900 |
6 | 0.50000 | 0.50000 | 0.50000 | 0,mx,-mz | 0.65500 | -0.65500 | -1.61900 |
(1/3,2/3,2/3) + set click here to show and hide |
7 | 0.83333 | 0.66667 | 0.66667 | mx,mx,mz | -0.65500 | -1.31000 | 1.61900 |
8 | 0.33333 | 0.16667 | 0.66667 | -mx,0,mz | 1.31000 | 0.65500 | 1.61900 |
9 | 0.83333 | 0.16667 | 0.66667 | 0,-mx,mz | -0.65500 | 0.65500 | 1.61900 |
(1/3,2/3,1/6)' + set click here to show and hide |
10 | 0.83333 | 0.66667 | 0.16667 | -mx,-mx,-mz | 0.65500 | 1.31000 | -1.61900 |
11 | 0.33333 | 0.16667 | 0.16667 | mx,0,-mz | -1.31000 | -0.65500 | -1.61900 |
12 | 0.83333 | 0.16667 | 0.16667 | 0,mx,-mz | 0.65500 | -0.65500 | -1.61900 |
(2/3,1/3,1/3) + set click here to show and hide |
13 | 0.16667 | 0.33333 | 0.33333 | mx,mx,mz | -0.65500 | -1.31000 | 1.61900 |
14 | 0.66667 | 0.83333 | 0.33333 | -mx,0,mz | 1.31000 | 0.65500 | 1.61900 |
15 | 0.16667 | 0.83333 | 0.33333 | 0,-mx,mz | -0.65500 | 0.65500 | 1.61900 |
(2/3,1/3,5/6)' + set click here to show and hide |
16 | 0.16667 | 0.33333 | 0.83333 | -mx,-mx,-mz | 0.65500 | 1.31000 | -1.61900 |
17 | 0.66667 | 0.83333 | 0.83333 | mx,0,-mz | -1.31000 | -0.65500 | -1.61900 |
18 | 0.16667 | 0.83333 | 0.83333 | 0,mx,-mz | 0.65500 | -0.65500 | -1.61900 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Ni1_2:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.00000 | 0.00000 | 0.00000 | 0,0,mz | 0.00000 | 0.00000 | -1.97700 |
(0,0,1/2)' + set click here to show and hide |
2 | 0.00000 | 0.00000 | 0.50000 | 0,0,-mz | 0.00000 | 0.00000 | 1.97700 |
(1/3,2/3,2/3) + set click here to show and hide |
3 | 0.33333 | 0.66667 | 0.66667 | 0,0,mz | 0.00000 | 0.00000 | -1.97700 |
(1/3,2/3,1/6)' + set click here to show and hide |
4 | 0.33333 | 0.66667 | 0.16667 | 0,0,-mz | 0.00000 | 0.00000 | 1.97700 |
(2/3,1/3,1/3) + set click here to show and hide |
5 | 0.66667 | 0.33333 | 0.33333 | 0,0,mz | 0.00000 | 0.00000 | -1.97700 |
(2/3,1/3,5/6)' + set click here to show and hide |
6 | 0.66667 | 0.33333 | 0.83333 | 0,0,-mz | 0.00000 | 0.00000 | 1.97700 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom O1_1:
Atom | x | y | z |
1 | 0.50000 | 0.00000 | 0.25000 |
2 | 0.00000 | 0.50000 | 0.25000 |
3 | 0.50000 | 0.50000 | 0.25000 |
(0,0,1/2)' + set click here to show and hide |
4 | 0.50000 | 0.00000 | 0.75000 |
5 | 0.00000 | 0.50000 | 0.75000 |
6 | 0.50000 | 0.50000 | 0.75000 |
(1/3,2/3,2/3) + set click here to show and hide |
7 | 0.83333 | 0.66667 | 0.91667 |
8 | 0.33333 | 0.16667 | 0.91667 |
9 | 0.83333 | 0.16667 | 0.91667 |
(1/3,2/3,1/6)' + set click here to show and hide |
10 | 0.83333 | 0.66667 | 0.41667 |
11 | 0.33333 | 0.16667 | 0.41667 |
12 | 0.83333 | 0.16667 | 0.41667 |
(2/3,1/3,1/3) + set click here to show and hide |
13 | 0.16667 | 0.33333 | 0.58333 |
14 | 0.66667 | 0.83333 | 0.58333 |
15 | 0.16667 | 0.83333 | 0.58333 |
(2/3,1/3,5/6)' + set click here to show and hide |
16 | 0.16667 | 0.33333 | 0.08333 |
17 | 0.66667 | 0.83333 | 0.08333 |
18 | 0.16667 | 0.83333 | 0.08333 |
Set of atoms in the unit cell related by symmetry with the atom O1_2:
Atom | x | y | z |
1 | 0.00000 | 0.00000 | 0.25000 |
(0,0,1/2)' + set click here to show and hide |
2 | 0.00000 | 0.00000 | 0.75000 |
(1/3,2/3,2/3) + set click here to show and hide |
3 | 0.33333 | 0.66667 | 0.91667 |
(1/3,2/3,1/6)' + set click here to show and hide |
4 | 0.33333 | 0.66667 | 0.41667 |
(2/3,1/3,1/3) + set click here to show and hide |
5 | 0.66667 | 0.33333 | 0.58333 |
(2/3,1/3,5/6)' + set click here to show and hide |
6 | 0.66667 | 0.33333 | 0.08333 |
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