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 Cu1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.00000 | 0.00000 | 0.00000 | mx,0,0 | 0.39000 | 0.00000 | 0.00000 |
2 | 0.50000 | 0.00000 | 0.75000 | 0,-mx,0 | 0.00000 | -0.39000 | 0.00000 |
(1/2,1/2,1/2) + set click here to show and hide |
3 | 0.50000 | 0.50000 | 0.50000 | mx,0,0 | 0.39000 | 0.00000 | 0.00000 |
4 | 0.00000 | 0.50000 | 0.25000 | 0,-mx,0 | 0.00000 | -0.39000 | 0.00000 |
(0,0,1/2)' + set click here to show and hide |
5 | 0.00000 | 0.00000 | 0.50000 | -mx,0,0 | -0.39000 | 0.00000 | 0.00000 |
6 | 0.50000 | 0.00000 | 0.25000 | 0,mx,0 | 0.00000 | 0.39000 | 0.00000 |
(1/2,1/2,0)' + set click here to show and hide |
7 | 0.50000 | 0.50000 | 0.00000 | -mx,0,0 | -0.39000 | 0.00000 | 0.00000 |
8 | 0.00000 | 0.50000 | 0.75000 | 0,mx,0 | 0.00000 | 0.39000 | 0.00000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom Sr1:
Atom | x | y | z |
1 | 0.00000 | 0.00000 | 0.20570 |
2 | 0.00000 | 0.00000 | 0.29430 |
3 | 0.50000 | 0.00000 | 0.54430 |
4 | 0.00000 | 0.50000 | 0.95570 |
(1/2,1/2,1/2) + set click here to show and hide |
5 | 0.50000 | 0.50000 | 0.70570 |
6 | 0.50000 | 0.50000 | 0.79430 |
7 | 0.00000 | 0.50000 | 0.04430 |
8 | 0.50000 | 0.00000 | 0.45570 |
(0,0,1/2)' + set click here to show and hide |
9 | 0.00000 | 0.00000 | 0.70570 |
10 | 0.00000 | 0.00000 | 0.79430 |
11 | 0.50000 | 0.00000 | 0.04430 |
12 | 0.00000 | 0.50000 | 0.45570 |
(1/2,1/2,0)' + set click here to show and hide |
13 | 0.50000 | 0.50000 | 0.20570 |
14 | 0.50000 | 0.50000 | 0.29430 |
15 | 0.00000 | 0.50000 | 0.54430 |
16 | 0.50000 | 0.00000 | 0.95570 |
Set of atoms in the unit cell related by symmetry with the atom O1:
Atom | x | y | z |
1 | 0.75000 | 0.25000 | 0.00000 |
2 | 0.25000 | 0.25000 | 0.50000 |
3 | 0.25000 | 0.75000 | 0.75000 |
4 | 0.75000 | 0.75000 | 0.75000 |
(1/2,1/2,1/2) + set click here to show and hide |
5 | 0.25000 | 0.75000 | 0.50000 |
6 | 0.75000 | 0.75000 | 0.00000 |
7 | 0.75000 | 0.25000 | 0.25000 |
8 | 0.25000 | 0.25000 | 0.25000 |
(0,0,1/2)' + set click here to show and hide |
9 | 0.75000 | 0.25000 | 0.50000 |
10 | 0.25000 | 0.25000 | 0.00000 |
11 | 0.25000 | 0.75000 | 0.25000 |
12 | 0.75000 | 0.75000 | 0.25000 |
(1/2,1/2,0)' + set click here to show and hide |
13 | 0.25000 | 0.75000 | 0.00000 |
14 | 0.75000 | 0.75000 | 0.50000 |
15 | 0.75000 | 0.25000 | 0.75000 |
16 | 0.25000 | 0.25000 | 0.75000 |
Set of atoms in the unit cell related by symmetry with the atom Cu2_1:
Atom | x | y | z |
1 | 0.75000 | 0.25000 | 0.12500 |
2 | 0.25000 | 0.25000 | 0.37500 |
(1/2,1/2,1/2) + set click here to show and hide |
3 | 0.25000 | 0.75000 | 0.62500 |
4 | 0.75000 | 0.75000 | 0.87500 |
(0,0,1/2)' + set click here to show and hide |
5 | 0.75000 | 0.25000 | 0.62500 |
6 | 0.25000 | 0.25000 | 0.87500 |
(1/2,1/2,0)' + set click here to show and hide |
7 | 0.25000 | 0.75000 | 0.12500 |
8 | 0.75000 | 0.75000 | 0.37500 |
Set of atoms in the unit cell related by symmetry with the atom Cu2_2:
Atom | x | y | z |
1 | 0.25000 | 0.25000 | 0.12500 |
2 | 0.75000 | 0.25000 | 0.37500 |
(1/2,1/2,1/2) + set click here to show and hide |
3 | 0.75000 | 0.75000 | 0.62500 |
4 | 0.25000 | 0.75000 | 0.87500 |
(0,0,1/2)' + set click here to show and hide |
5 | 0.25000 | 0.25000 | 0.62500 |
6 | 0.75000 | 0.25000 | 0.87500 |
(1/2,1/2,0)' + set click here to show and hide |
7 | 0.75000 | 0.75000 | 0.12500 |
8 | 0.25000 | 0.75000 | 0.37500 |
Set of atoms in the unit cell related by symmetry with the atom Se1:
Atom | x | y | z |
1 | 0.00000 | 0.00000 | 0.08425 |
2 | 0.00000 | 0.00000 | 0.41575 |
3 | 0.50000 | 0.00000 | 0.66575 |
4 | 0.00000 | 0.50000 | 0.83425 |
(1/2,1/2,1/2) + set click here to show and hide |
5 | 0.50000 | 0.50000 | 0.58425 |
6 | 0.50000 | 0.50000 | 0.91575 |
7 | 0.00000 | 0.50000 | 0.16575 |
8 | 0.50000 | 0.00000 | 0.33425 |
(0,0,1/2)' + set click here to show and hide |
9 | 0.00000 | 0.00000 | 0.58425 |
10 | 0.00000 | 0.00000 | 0.91575 |
11 | 0.50000 | 0.00000 | 0.16575 |
12 | 0.00000 | 0.50000 | 0.33425 |
(1/2,1/2,0)' + set click here to show and hide |
13 | 0.50000 | 0.50000 | 0.08425 |
14 | 0.50000 | 0.50000 | 0.41575 |
15 | 0.00000 | 0.50000 | 0.66575 |
16 | 0.50000 | 0.00000 | 0.83425 |
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