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_1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.00000 | 0.00000 | 0.00000 | mx,-mx,mz | 0.00000 | 0.00000 | -1.00000 |
2 | 0.16667 | 0.83333 | 0.00000 | mx,-mx,mz | 0.00000 | 0.00000 | -1.00000 |
(1/3,2/3,0) + set click here to show and hide |
3 | 0.33333 | 0.66667 | 0.00000 | mx,-mx,mz | 0.00000 | 0.00000 | -1.00000 |
4 | 0.50000 | 0.50000 | 0.00000 | mx,-mx,mz | 0.00000 | 0.00000 | -1.00000 |
(2/3,1/3,0) + set click here to show and hide |
5 | 0.66667 | 0.33333 | 0.00000 | mx,-mx,mz | 0.00000 | 0.00000 | -1.00000 |
6 | 0.83333 | 0.16667 | 0.00000 | mx,-mx,mz | 0.00000 | 0.00000 | -1.00000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Fe1_2:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.00000 | 0.16667 | 0.00000 | mx,-mx,mz | 0.00000 | 0.00000 | 1.00000 |
2 | 0.16667 | 0.66666 | 0.00000 | mx,-mx,mz | 0.00000 | 0.00000 | 1.00000 |
(1/3,2/3,0) + set click here to show and hide |
3 | 0.33333 | 0.83334 | 0.00000 | mx,-mx,mz | 0.00000 | 0.00000 | 1.00000 |
4 | 0.50000 | 0.33333 | 0.00000 | mx,-mx,mz | 0.00000 | 0.00000 | 1.00000 |
(2/3,1/3,0) + set click here to show and hide |
5 | 0.66667 | 0.50000 | 0.00000 | mx,-mx,mz | 0.00000 | 0.00000 | 1.00000 |
6 | 0.83333 | 0.00000 | 0.00000 | mx,-mx,mz | 0.00000 | 0.00000 | 1.00000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Fe1_3:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.00000 | 0.33333 | 0.00000 | mx,my,mz | 0.00000 | 0.00000 | 1.00000 |
2 | 0.16667 | 0.50000 | 0.00000 | mx,my,mz | 0.00000 | 0.00000 | 1.00000 |
3 | 0.50000 | 0.83333 | 0.00000 | -my,-mx,mz | 0.00000 | 0.00000 | 1.00000 |
4 | 0.66667 | 0.00000 | 0.00000 | -my,-mx,mz | 0.00000 | 0.00000 | 1.00000 |
(1/3,2/3,0) + set click here to show and hide |
5 | 0.33333 | 0.00000 | 0.00000 | mx,my,mz | 0.00000 | 0.00000 | 1.00000 |
6 | 0.50000 | 0.16667 | 0.00000 | mx,my,mz | 0.00000 | 0.00000 | 1.00000 |
7 | 0.83333 | 0.50000 | 0.00000 | -my,-mx,mz | 0.00000 | 0.00000 | 1.00000 |
8 | 0.00000 | 0.66667 | 0.00000 | -my,-mx,mz | 0.00000 | 0.00000 | 1.00000 |
(2/3,1/3,0) + set click here to show and hide |
9 | 0.66667 | 0.66666 | 0.00000 | mx,my,mz | 0.00000 | 0.00000 | 1.00000 |
10 | 0.83333 | 0.83334 | 0.00000 | mx,my,mz | 0.00000 | 0.00000 | 1.00000 |
11 | 0.16666 | 0.16667 | 0.00000 | -my,-mx,mz | 0.00000 | 0.00000 | 1.00000 |
12 | 0.33334 | 0.33333 | 0.00000 | -my,-mx,mz | 0.00000 | 0.00000 | 1.00000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Fe1_4:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.00000 | 0.50000 | 0.00000 | mx,-mx,mz | 0.00000 | 0.00000 | 1.00000 |
2 | 0.16667 | 0.33333 | 0.00000 | mx,-mx,mz | 0.00000 | 0.00000 | 1.00000 |
(1/3,2/3,0) + set click here to show and hide |
3 | 0.33333 | 0.16667 | 0.00000 | mx,-mx,mz | 0.00000 | 0.00000 | 1.00000 |
4 | 0.50000 | 0.00000 | 0.00000 | mx,-mx,mz | 0.00000 | 0.00000 | 1.00000 |
(2/3,1/3,0) + set click here to show and hide |
5 | 0.66667 | 0.83333 | 0.00000 | mx,-mx,mz | 0.00000 | 0.00000 | 1.00000 |
6 | 0.83333 | 0.66667 | 0.00000 | mx,-mx,mz | 0.00000 | 0.00000 | 1.00000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Fe1_5:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.00000 | 0.83333 | 0.00000 | mx,-mx,mz | 0.00000 | 0.00000 | -1.00000 |
2 | 0.16667 | 0.00000 | 0.00000 | mx,-mx,mz | 0.00000 | 0.00000 | -1.00000 |
(1/3,2/3,0) + set click here to show and hide |
3 | 0.33333 | 0.50000 | 0.00000 | mx,-mx,mz | 0.00000 | 0.00000 | -1.00000 |
4 | 0.50000 | 0.66667 | 0.00000 | mx,-mx,mz | 0.00000 | 0.00000 | -1.00000 |
(2/3,1/3,0) + set click here to show and hide |
5 | 0.66667 | 0.16666 | 0.00000 | mx,-mx,mz | 0.00000 | 0.00000 | -1.00000 |
6 | 0.83333 | 0.33333 | 0.00000 | mx,-mx,mz | 0.00000 | 0.00000 | -1.00000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom I1_1:
Atom | x | y | z |
1 | 0.05556 | 0.11111 | 0.25000 |
2 | 0.11111 | 0.72222 | 0.75000 |
3 | 0.27778 | 0.88889 | 0.75000 |
4 | 0.88889 | 0.94444 | 0.25000 |
(1/3,2/3,0) + set click here to show and hide |
5 | 0.38889 | 0.77778 | 0.25000 |
6 | 0.44444 | 0.38889 | 0.75000 |
7 | 0.61111 | 0.55556 | 0.75000 |
8 | 0.22222 | 0.61111 | 0.25000 |
(2/3,1/3,0) + set click here to show and hide |
9 | 0.72223 | 0.44444 | 0.25000 |
10 | 0.77777 | 0.05556 | 0.75000 |
11 | 0.94444 | 0.22223 | 0.75000 |
12 | 0.55556 | 0.27777 | 0.25000 |
Set of atoms in the unit cell related by symmetry with the atom I1_2:
Atom | x | y | z |
1 | 0.11111 | 0.05556 | 0.75000 |
2 | 0.05556 | 0.77777 | 0.25000 |
3 | 0.22223 | 0.94444 | 0.25000 |
4 | 0.94444 | 0.88889 | 0.75000 |
(1/3,2/3,0) + set click here to show and hide |
5 | 0.44444 | 0.72223 | 0.75000 |
6 | 0.38889 | 0.44444 | 0.25000 |
7 | 0.55556 | 0.61111 | 0.25000 |
8 | 0.27777 | 0.55556 | 0.75000 |
(2/3,1/3,0) + set click here to show and hide |
9 | 0.77778 | 0.38889 | 0.75000 |
10 | 0.72222 | 0.11111 | 0.25000 |
11 | 0.88889 | 0.27778 | 0.25000 |
12 | 0.61111 | 0.22222 | 0.75000 |
Set of atoms in the unit cell related by symmetry with the atom I1_3:
Atom | x | y | z |
1 | 0.05556 | 0.27778 | 0.25000 |
2 | 0.11111 | 0.55555 | 0.75000 |
3 | 0.44445 | 0.88889 | 0.75000 |
4 | 0.72222 | 0.94444 | 0.25000 |
(1/3,2/3,0) + set click here to show and hide |
5 | 0.38889 | 0.94445 | 0.25000 |
6 | 0.44444 | 0.22222 | 0.75000 |
7 | 0.77778 | 0.55556 | 0.75000 |
8 | 0.05555 | 0.61111 | 0.25000 |
(2/3,1/3,0) + set click here to show and hide |
9 | 0.72223 | 0.61111 | 0.25000 |
10 | 0.77777 | 0.88889 | 0.75000 |
11 | 0.11111 | 0.22223 | 0.75000 |
12 | 0.38889 | 0.27777 | 0.25000 |
Set of atoms in the unit cell related by symmetry with the atom I1_4:
Atom | x | y | z |
1 | 0.05556 | 0.44444 | 0.25000 |
2 | 0.11111 | 0.38889 | 0.75000 |
3 | 0.61111 | 0.88889 | 0.75000 |
4 | 0.55556 | 0.94444 | 0.25000 |
(1/3,2/3,0) + set click here to show and hide |
5 | 0.38889 | 0.11111 | 0.25000 |
6 | 0.44444 | 0.05556 | 0.75000 |
7 | 0.94444 | 0.55556 | 0.75000 |
8 | 0.88889 | 0.61111 | 0.25000 |
(2/3,1/3,0) + set click here to show and hide |
9 | 0.72223 | 0.77777 | 0.25000 |
10 | 0.77777 | 0.72223 | 0.75000 |
11 | 0.27777 | 0.22223 | 0.75000 |
12 | 0.22223 | 0.27777 | 0.25000 |
Set of atoms in the unit cell related by symmetry with the atom I1_5:
Atom | x | y | z |
1 | 0.05556 | 0.94444 | 0.25000 |
2 | 0.11111 | 0.88889 | 0.75000 |
(1/3,2/3,0) + set click here to show and hide |
3 | 0.38889 | 0.61111 | 0.25000 |
4 | 0.44444 | 0.55556 | 0.75000 |
(2/3,1/3,0) + set click here to show and hide |
5 | 0.72223 | 0.27777 | 0.25000 |
6 | 0.77777 | 0.22223 | 0.75000 |
Set of atoms in the unit cell related by symmetry with the atom I1_6:
Atom | x | y | z |
1 | 0.22222 | 0.11111 | 0.25000 |
2 | 0.94445 | 0.72222 | 0.75000 |
3 | 0.27778 | 0.05555 | 0.75000 |
4 | 0.88889 | 0.77778 | 0.25000 |
(1/3,2/3,0) + set click here to show and hide |
5 | 0.55555 | 0.77778 | 0.25000 |
6 | 0.27778 | 0.38889 | 0.75000 |
7 | 0.61111 | 0.72222 | 0.75000 |
8 | 0.22222 | 0.44445 | 0.25000 |
(2/3,1/3,0) + set click here to show and hide |
9 | 0.88889 | 0.44444 | 0.25000 |
10 | 0.61111 | 0.05556 | 0.75000 |
11 | 0.94444 | 0.38889 | 0.75000 |
12 | 0.55556 | 0.11111 | 0.25000 |
Set of atoms in the unit cell related by symmetry with the atom I1_7:
Atom | x | y | z |
1 | 0.22222 | 0.77778 | 0.25000 |
2 | 0.94445 | 0.05555 | 0.75000 |
(1/3,2/3,0) + set click here to show and hide |
3 | 0.55555 | 0.44445 | 0.25000 |
4 | 0.27778 | 0.72222 | 0.75000 |
(2/3,1/3,0) + set click here to show and hide |
5 | 0.88889 | 0.11111 | 0.25000 |
6 | 0.61111 | 0.38889 | 0.75000 |
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