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:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.25000 | 0.25000 | 0.20648 | mx,mx,0 | 2.57500 | 2.57500 | 0.00000 |
2 | 0.75000 | 0.25000 | 0.79352 | mx,-mx,0 | 2.57500 | -2.57500 | 0.00000 |
(1/2,1/2,0)' + set click here to show and hide |
3 | 0.75000 | 0.75000 | 0.20648 | -mx,-mx,0 | -2.57500 | -2.57500 | 0.00000 |
4 | 0.25000 | 0.75000 | 0.79352 | -mx,mx,0 | -2.57500 | 2.57500 | 0.00000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom Ca1:
Atom | x | y | z |
1 | 0.25000 | 0.75000 | 0.09240 |
2 | 0.75000 | 0.75000 | 0.90760 |
(1/2,1/2,0)' + set click here to show and hide |
3 | 0.75000 | 0.25000 | 0.09240 |
4 | 0.25000 | 0.25000 | 0.90760 |
Set of atoms in the unit cell related by symmetry with the atom Ca2:
Atom | x | y | z |
1 | 0.25000 | 0.75000 | 0.34440 |
2 | 0.75000 | 0.75000 | 0.65560 |
(1/2,1/2,0)' + set click here to show and hide |
3 | 0.75000 | 0.25000 | 0.34440 |
4 | 0.25000 | 0.25000 | 0.65560 |
Set of atoms in the unit cell related by symmetry with the atom O1_1:
Atom | x | y | z |
1 | 0.00000 | 0.00000 | 0.23160 |
2 | 0.50000 | 0.50000 | 0.76840 |
(1/2,1/2,0)' + set click here to show and hide |
3 | 0.50000 | 0.50000 | 0.23160 |
4 | 0.00000 | 0.00000 | 0.76840 |
Set of atoms in the unit cell related by symmetry with the atom O1_2:
Atom | x | y | z |
1 | 0.00000 | 0.50000 | 0.23160 |
2 | 0.50000 | 0.00000 | 0.76840 |
(1/2,1/2,0)' + set click here to show and hide |
3 | 0.50000 | 0.00000 | 0.23160 |
4 | 0.00000 | 0.50000 | 0.76840 |
Set of atoms in the unit cell related by symmetry with the atom O2:
Atom | x | y | z |
1 | 0.25000 | 0.25000 | 0.06810 |
2 | 0.75000 | 0.25000 | 0.93190 |
(1/2,1/2,0)' + set click here to show and hide |
3 | 0.75000 | 0.75000 | 0.06810 |
4 | 0.25000 | 0.75000 | 0.93190 |
Set of atoms in the unit cell related by symmetry with the atom Cl1:
Atom | x | y | z |
1 | 0.25000 | 0.25000 | 0.42360 |
2 | 0.75000 | 0.25000 | 0.57640 |
(1/2,1/2,0)' + set click here to show and hide |
3 | 0.75000 | 0.75000 | 0.42360 |
4 | 0.25000 | 0.75000 | 0.57640 |
[Hide]