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 Nd1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.50000 | 0.00000 | 0.00000 | mx,2mx,mz | 0.88000 | 1.76000 | -0.93000 |
2 | 0.00000 | 0.50000 | 0.00000 | -2mx,-mx,mz | -1.76000 | -0.88000 | -0.93000 |
3 | 0.50000 | 0.50000 | 0.00000 | mx,-mx,mz | 0.88000 | -0.88000 | -0.93000 |
(1/3,2/3,2/3) + set click here to show and hide |
4 | 0.83333 | 0.66667 | 0.66667 | mx,2mx,mz | 0.88000 | 1.76000 | -0.93000 |
5 | 0.33333 | 0.16667 | 0.66667 | -2mx,-mx,mz | -1.76000 | -0.88000 | -0.93000 |
6 | 0.83333 | 0.16667 | 0.66667 | mx,-mx,mz | 0.88000 | -0.88000 | -0.93000 |
(2/3,1/3,1/3) + set click here to show and hide |
7 | 0.16667 | 0.33333 | 0.33333 | mx,2mx,mz | 0.88000 | 1.76000 | -0.93000 |
8 | 0.66667 | 0.83333 | 0.33333 | -2mx,-mx,mz | -1.76000 | -0.88000 | -0.93000 |
9 | 0.16667 | 0.83333 | 0.33333 | mx,-mx,mz | 0.88000 | -0.88000 | -0.93000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom Mg1:
Atom | x | y | z |
1 | 0.00000 | 0.00000 | 0.50000 |
(1/3,2/3,2/3) + set click here to show and hide |
2 | 0.33333 | 0.66667 | 0.16667 |
(2/3,1/3,1/3) + set click here to show and hide |
3 | 0.66667 | 0.33333 | 0.83333 |
Set of atoms in the unit cell related by symmetry with the atom Mg2:
Atom | x | y | z |
1 | 0.00000 | 0.00000 | 0.00000 |
(1/3,2/3,2/3) + set click here to show and hide |
2 | 0.33333 | 0.66667 | 0.66667 |
(2/3,1/3,1/3) + set click here to show and hide |
3 | 0.66667 | 0.33333 | 0.33333 |
Set of atoms in the unit cell related by symmetry with the atom Sb1:
Atom | x | y | z |
1 | 0.50000 | 0.00000 | 0.50000 |
2 | 0.00000 | 0.50000 | 0.50000 |
3 | 0.50000 | 0.50000 | 0.50000 |
(1/3,2/3,2/3) + set click here to show and hide |
4 | 0.83333 | 0.66667 | 0.16667 |
5 | 0.33333 | 0.16667 | 0.16667 |
6 | 0.83333 | 0.16667 | 0.16667 |
(2/3,1/3,1/3) + set click here to show and hide |
7 | 0.16667 | 0.33333 | 0.83333 |
8 | 0.66667 | 0.83333 | 0.83333 |
9 | 0.16667 | 0.83333 | 0.83333 |
Set of atoms in the unit cell related by symmetry with the atom O1:
Atom | x | y | z |
1 | 0.00000 | 0.00000 | 0.60300 |
2 | 0.00000 | 0.00000 | 0.39700 |
(1/3,2/3,2/3) + set click here to show and hide |
3 | 0.33333 | 0.66667 | 0.26967 |
4 | 0.33333 | 0.66667 | 0.06367 |
(2/3,1/3,1/3) + set click here to show and hide |
5 | 0.66667 | 0.33333 | 0.93633 |
6 | 0.66667 | 0.33333 | 0.73033 |
Set of atoms in the unit cell related by symmetry with the atom O2:
Atom | x | y | z |
1 | 0.53600 | 0.46400 | 0.38800 |
2 | 0.53600 | 0.07200 | 0.38800 |
3 | 0.92800 | 0.46400 | 0.38800 |
4 | 0.46400 | 0.53600 | 0.61200 |
5 | 0.46400 | 0.92800 | 0.61200 |
6 | 0.07200 | 0.53600 | 0.61200 |
(1/3,2/3,2/3) + set click here to show and hide |
7 | 0.86933 | 0.13067 | 0.05467 |
8 | 0.86933 | 0.73867 | 0.05467 |
9 | 0.26133 | 0.13067 | 0.05467 |
10 | 0.79733 | 0.20267 | 0.27867 |
11 | 0.79733 | 0.59467 | 0.27867 |
12 | 0.40533 | 0.20267 | 0.27867 |
(2/3,1/3,1/3) + set click here to show and hide |
13 | 0.20267 | 0.79733 | 0.72133 |
14 | 0.20267 | 0.40533 | 0.72133 |
15 | 0.59467 | 0.79733 | 0.72133 |
16 | 0.13067 | 0.86933 | 0.94533 |
17 | 0.13067 | 0.26133 | 0.94533 |
18 | 0.73867 | 0.86933 | 0.94533 |
Set of atoms in the unit cell related by symmetry with the atom O3:
Atom | x | y | z |
1 | 0.47500 | 0.52500 | 0.85900 |
2 | 0.47500 | 0.95000 | 0.85900 |
3 | 0.05000 | 0.52500 | 0.85900 |
4 | 0.52500 | 0.47500 | 0.14100 |
5 | 0.52500 | 0.05000 | 0.14100 |
6 | 0.95000 | 0.47500 | 0.14100 |
(1/3,2/3,2/3) + set click here to show and hide |
7 | 0.80833 | 0.19167 | 0.52567 |
8 | 0.80833 | 0.61667 | 0.52567 |
9 | 0.38333 | 0.19167 | 0.52567 |
10 | 0.85833 | 0.14167 | 0.80767 |
11 | 0.85833 | 0.71667 | 0.80767 |
12 | 0.28333 | 0.14167 | 0.80767 |
(2/3,1/3,1/3) + set click here to show and hide |
13 | 0.14167 | 0.85833 | 0.19233 |
14 | 0.14167 | 0.28333 | 0.19233 |
15 | 0.71667 | 0.85833 | 0.19233 |
16 | 0.19167 | 0.80833 | 0.47433 |
17 | 0.19167 | 0.38333 | 0.47433 |
18 | 0.61667 | 0.80833 | 0.47433 |
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