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 Mn1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.00000 | 0.16610 | 0.00000 | mx,0,mz | 0.80000 | 0.00000 | 2.49000 |
2 | 0.00000 | 0.83390 | 0.50000 | mx,0,mz | 0.80000 | 0.00000 | 2.49000 |
(1/2,1/2,0) + set click here to show and hide |
3 | 0.50000 | 0.66610 | 0.00000 | mx,0,mz | 0.80000 | 0.00000 | 2.49000 |
4 | 0.50000 | 0.33390 | 0.50000 | mx,0,mz | 0.80000 | 0.00000 | 2.49000 |
(0,0,1/2)' + set click here to show and hide |
5 | 0.00000 | 0.16610 | 0.50000 | -mx,0,-mz | -0.80000 | 0.00000 | -2.49000 |
6 | 0.00000 | 0.83390 | 0.00000 | -mx,0,-mz | -0.80000 | 0.00000 | -2.49000 |
(1/2,1/2,1/2)' + set click here to show and hide |
7 | 0.50000 | 0.66610 | 0.50000 | -mx,0,-mz | -0.80000 | 0.00000 | -2.49000 |
8 | 0.50000 | 0.33390 | 0.00000 | -mx,0,-mz | -0.80000 | 0.00000 | -2.49000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom Li1:
Atom | x | y | z |
1 | 0.00000 | 0.50000 | 0.00000 |
(1/2,1/2,0) + set click here to show and hide |
2 | 0.50000 | 0.00000 | 0.00000 |
(0,0,1/2)' + set click here to show and hide |
3 | 0.00000 | 0.50000 | 0.50000 |
(1/2,1/2,1/2)' + set click here to show and hide |
4 | 0.50000 | 0.00000 | 0.50000 |
Set of atoms in the unit cell related by symmetry with the atom Li2:
Atom | x | y | z |
1 | 0.00000 | 0.00000 | 0.25000 |
(1/2,1/2,0) + set click here to show and hide |
2 | 0.50000 | 0.50000 | 0.25000 |
(0,0,1/2)' + set click here to show and hide |
3 | 0.00000 | 0.00000 | 0.75000 |
(1/2,1/2,1/2)' + set click here to show and hide |
4 | 0.50000 | 0.50000 | 0.75000 |
Set of atoms in the unit cell related by symmetry with the atom Li3:
Atom | x | y | z |
1 | 0.00000 | 0.66170 | 0.25000 |
2 | 0.00000 | 0.33830 | 0.25000 |
(1/2,1/2,0) + set click here to show and hide |
3 | 0.50000 | 0.16170 | 0.25000 |
4 | 0.50000 | 0.83830 | 0.25000 |
(0,0,1/2)' + set click here to show and hide |
5 | 0.00000 | 0.66170 | 0.75000 |
6 | 0.00000 | 0.33830 | 0.75000 |
(1/2,1/2,1/2)' + set click here to show and hide |
7 | 0.50000 | 0.16170 | 0.75000 |
8 | 0.50000 | 0.83830 | 0.75000 |
Set of atoms in the unit cell related by symmetry with the atom O1:
Atom | x | y | z |
1 | 0.21900 | 0.00000 | 0.11300 |
2 | 0.78100 | 0.00000 | 0.38700 |
(1/2,1/2,0) + set click here to show and hide |
3 | 0.71900 | 0.50000 | 0.11300 |
4 | 0.28100 | 0.50000 | 0.38700 |
(0,0,1/2)' + set click here to show and hide |
5 | 0.21900 | 0.00000 | 0.61300 |
6 | 0.78100 | 0.00000 | 0.88700 |
(1/2,1/2,1/2)' + set click here to show and hide |
7 | 0.71900 | 0.50000 | 0.61300 |
8 | 0.28100 | 0.50000 | 0.88700 |
Set of atoms in the unit cell related by symmetry with the atom O2:
Atom | x | y | z |
1 | 0.25330 | 0.32380 | 0.11155 |
2 | 0.74670 | 0.32380 | 0.38845 |
3 | 0.74670 | 0.67620 | 0.38845 |
4 | 0.25330 | 0.67620 | 0.11155 |
(1/2,1/2,0) + set click here to show and hide |
5 | 0.75330 | 0.82380 | 0.11155 |
6 | 0.24670 | 0.82380 | 0.38845 |
7 | 0.24670 | 0.17620 | 0.38845 |
8 | 0.75330 | 0.17620 | 0.11155 |
(0,0,1/2)' + set click here to show and hide |
9 | 0.25330 | 0.32380 | 0.61155 |
10 | 0.74670 | 0.32380 | 0.88845 |
11 | 0.74670 | 0.67620 | 0.88845 |
12 | 0.25330 | 0.67620 | 0.61155 |
(1/2,1/2,1/2)' + set click here to show and hide |
13 | 0.75330 | 0.82380 | 0.61155 |
14 | 0.24670 | 0.82380 | 0.88845 |
15 | 0.24670 | 0.17620 | 0.88845 |
16 | 0.75330 | 0.17620 | 0.61155 |
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