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_1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.25000 | 0.75000 | 0.75000 | 0,0,mz | 0.00000 | 0.00000 | -0.93000 |
2 | 0.75000 | 0.25000 | 0.25000 | 0,0,mz | 0.00000 | 0.00000 | -0.93000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Cu1_2:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.75000 | 0.25000 | 0.75000 | 0,0,mz | 0.00000 | 0.00000 | -0.93000 |
2 | 0.25000 | 0.75000 | 0.25000 | 0,0,mz | 0.00000 | 0.00000 | -0.93000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Cu1_3:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.75000 | 0.75000 | 0.25000 | 0,0,mz | 0.00000 | 0.00000 | -0.93000 |
2 | 0.25000 | 0.25000 | 0.75000 | 0,0,mz | 0.00000 | 0.00000 | -0.93000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Fe1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.00000 | 0.00000 | 0.00000 | mx,my,mz | 0.00000 | 0.00000 | 4.33000 |
2 | 0.50000 | 0.50000 | 0.00000 | -mx,-my,mz | 0.00000 | 0.00000 | 4.33000 |
3 | 0.50000 | 0.00000 | 0.50000 | mx,-my,mz | 0.00000 | 0.00000 | 4.33000 |
4 | 0.00000 | 0.50000 | 0.50000 | -mx,my,mz | 0.00000 | 0.00000 | 4.33000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom Ca1:
Atom | x | y | z |
1 | 0.25000 | 0.25000 | 0.25000 |
2 | 0.75000 | 0.75000 | 0.75000 |
Set of atoms in the unit cell related by symmetry with the atom Sb1:
Atom | x | y | z |
1 | 0.50000 | 0.50000 | 0.50000 |
2 | 0.00000 | 0.00000 | 0.50000 |
3 | 0.00000 | 0.50000 | 0.00000 |
4 | 0.50000 | 0.00000 | 0.00000 |
Set of atoms in the unit cell related by symmetry with the atom O1_1:
Atom | x | y | z |
1 | 0.75280 | 0.92560 | 0.05580 |
2 | 0.74720 | 0.57440 | 0.05580 |
3 | 0.24720 | 0.07440 | 0.94420 |
4 | 0.25280 | 0.42560 | 0.94420 |
5 | 0.74720 | 0.92560 | 0.44420 |
6 | 0.75280 | 0.57440 | 0.44420 |
7 | 0.25280 | 0.07440 | 0.55580 |
8 | 0.24720 | 0.42560 | 0.55580 |
Set of atoms in the unit cell related by symmetry with the atom O1_2:
Atom | x | y | z |
1 | 0.05580 | 0.75280 | 0.92560 |
2 | 0.44420 | 0.74720 | 0.92560 |
3 | 0.94420 | 0.24720 | 0.07440 |
4 | 0.55580 | 0.25280 | 0.07440 |
5 | 0.44420 | 0.75280 | 0.57440 |
6 | 0.05580 | 0.74720 | 0.57440 |
7 | 0.55580 | 0.24720 | 0.42560 |
8 | 0.94420 | 0.25280 | 0.42560 |
Set of atoms in the unit cell related by symmetry with the atom O1_3:
Atom | x | y | z |
1 | 0.92560 | 0.05580 | 0.75280 |
2 | 0.57440 | 0.44420 | 0.75280 |
3 | 0.07440 | 0.94420 | 0.24720 |
4 | 0.42560 | 0.55580 | 0.24720 |
5 | 0.57440 | 0.05580 | 0.74720 |
6 | 0.92560 | 0.44420 | 0.74720 |
7 | 0.42560 | 0.94420 | 0.25280 |
8 | 0.07440 | 0.55580 | 0.25280 |
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