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 | 0.00000 | 0.00000 | mx,my,mz | 0.30000 | -2.20000 | -3.20000 |
2 | 0.00000 | 0.00000 | 0.50000 | mx,my,mz | 0.30000 | -2.20000 | -3.20000 |
(0,1/2,1/2) + set click here to show and hide |
3 | 0.00000 | 0.50000 | 0.50000 | mx,my,mz | 0.30000 | -2.20000 | -3.20000 |
4 | 0.00000 | 0.50000 | 0.00000 | mx,my,mz | 0.30000 | -2.20000 | -3.20000 |
(1/2,0,1/2) + set click here to show and hide |
5 | 0.50000 | 0.00000 | 0.50000 | mx,my,mz | 0.30000 | -2.20000 | -3.20000 |
6 | 0.50000 | 0.00000 | 0.00000 | mx,my,mz | 0.30000 | -2.20000 | -3.20000 |
(1/2,1/2,0) + set click here to show and hide |
7 | 0.50000 | 0.50000 | 0.00000 | mx,my,mz | 0.30000 | -2.20000 | -3.20000 |
8 | 0.50000 | 0.50000 | 0.50000 | mx,my,mz | 0.30000 | -2.20000 | -3.20000 |
(1/4,3/4,1/2)' + set click here to show and hide |
9 | 0.25000 | 0.75000 | 0.50000 | -mx,-my,-mz | -0.30000 | 2.20000 | 3.20000 |
10 | 0.25000 | 0.75000 | 0.00000 | -mx,-my,-mz | -0.30000 | 2.20000 | 3.20000 |
(1/4,1/4,0)' + set click here to show and hide |
11 | 0.25000 | 0.25000 | 0.00000 | -mx,-my,-mz | -0.30000 | 2.20000 | 3.20000 |
12 | 0.25000 | 0.25000 | 0.50000 | -mx,-my,-mz | -0.30000 | 2.20000 | 3.20000 |
(3/4,3/4,0)' + set click here to show and hide |
13 | 0.75000 | 0.75000 | 0.00000 | -mx,-my,-mz | -0.30000 | 2.20000 | 3.20000 |
14 | 0.75000 | 0.75000 | 0.50000 | -mx,-my,-mz | -0.30000 | 2.20000 | 3.20000 |
(3/4,1/4,1/2)' + set click here to show and hide |
15 | 0.75000 | 0.25000 | 0.50000 | -mx,-my,-mz | -0.30000 | 2.20000 | 3.20000 |
16 | 0.75000 | 0.25000 | 0.00000 | -mx,-my,-mz | -0.30000 | 2.20000 | 3.20000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Mn2_1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.29217 | 0.00000 | 0.18960 | mx,my,mz | 0.20000 | -2.70000 | -3.10000 |
2 | 0.70783 | 0.00000 | 0.31040 | mx,my,mz | 0.20000 | -2.70000 | -3.10000 |
(0,1/2,1/2) + set click here to show and hide |
3 | 0.29217 | 0.50000 | 0.68960 | mx,my,mz | 0.20000 | -2.70000 | -3.10000 |
4 | 0.70783 | 0.50000 | 0.81040 | mx,my,mz | 0.20000 | -2.70000 | -3.10000 |
(1/2,0,1/2) + set click here to show and hide |
5 | 0.79217 | 0.00000 | 0.68960 | mx,my,mz | 0.20000 | -2.70000 | -3.10000 |
6 | 0.20783 | 0.00000 | 0.81040 | mx,my,mz | 0.20000 | -2.70000 | -3.10000 |
(1/2,1/2,0) + set click here to show and hide |
7 | 0.79217 | 0.50000 | 0.18960 | mx,my,mz | 0.20000 | -2.70000 | -3.10000 |
8 | 0.20783 | 0.50000 | 0.31040 | mx,my,mz | 0.20000 | -2.70000 | -3.10000 |
(1/4,3/4,1/2)' + set click here to show and hide |
9 | 0.54217 | 0.75000 | 0.68960 | -mx,-my,-mz | -0.20000 | 2.70000 | 3.10000 |
10 | 0.95783 | 0.75000 | 0.81040 | -mx,-my,-mz | -0.20000 | 2.70000 | 3.10000 |
(1/4,1/4,0)' + set click here to show and hide |
11 | 0.54217 | 0.25000 | 0.18960 | -mx,-my,-mz | -0.20000 | 2.70000 | 3.10000 |
12 | 0.95783 | 0.25000 | 0.31040 | -mx,-my,-mz | -0.20000 | 2.70000 | 3.10000 |
(3/4,3/4,0)' + set click here to show and hide |
13 | 0.04217 | 0.75000 | 0.18960 | -mx,-my,-mz | -0.20000 | 2.70000 | 3.10000 |
14 | 0.45783 | 0.75000 | 0.31040 | -mx,-my,-mz | -0.20000 | 2.70000 | 3.10000 |
(3/4,1/4,1/2)' + set click here to show and hide |
15 | 0.04217 | 0.25000 | 0.68960 | -mx,-my,-mz | -0.20000 | 2.70000 | 3.10000 |
16 | 0.45783 | 0.25000 | 0.81040 | -mx,-my,-mz | -0.20000 | 2.70000 | 3.10000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Mn2_2:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.70783 | 0.00000 | 0.81039 | mx,my,mz | 2.50000 | 1.20000 | 1.70000 |
2 | 0.29217 | 0.00000 | 0.68961 | mx,my,mz | 2.50000 | 1.20000 | 1.70000 |
(0,1/2,1/2) + set click here to show and hide |
3 | 0.70783 | 0.50000 | 0.31039 | mx,my,mz | 2.50000 | 1.20000 | 1.70000 |
4 | 0.29217 | 0.50000 | 0.18961 | mx,my,mz | 2.50000 | 1.20000 | 1.70000 |
(1/2,0,1/2) + set click here to show and hide |
5 | 0.20783 | 0.00000 | 0.31039 | mx,my,mz | 2.50000 | 1.20000 | 1.70000 |
6 | 0.79217 | 0.00000 | 0.18961 | mx,my,mz | 2.50000 | 1.20000 | 1.70000 |
(1/2,1/2,0) + set click here to show and hide |
7 | 0.20783 | 0.50000 | 0.81039 | mx,my,mz | 2.50000 | 1.20000 | 1.70000 |
8 | 0.79217 | 0.50000 | 0.68961 | mx,my,mz | 2.50000 | 1.20000 | 1.70000 |
(1/4,3/4,1/2)' + set click here to show and hide |
9 | 0.95783 | 0.75000 | 0.31039 | -mx,-my,-mz | -2.50000 | -1.20000 | -1.70000 |
10 | 0.54217 | 0.75000 | 0.18961 | -mx,-my,-mz | -2.50000 | -1.20000 | -1.70000 |
(1/4,1/4,0)' + set click here to show and hide |
11 | 0.95783 | 0.25000 | 0.81039 | -mx,-my,-mz | -2.50000 | -1.20000 | -1.70000 |
12 | 0.54217 | 0.25000 | 0.68961 | -mx,-my,-mz | -2.50000 | -1.20000 | -1.70000 |
(3/4,3/4,0)' + set click here to show and hide |
13 | 0.45783 | 0.75000 | 0.81039 | -mx,-my,-mz | -2.50000 | -1.20000 | -1.70000 |
14 | 0.04217 | 0.75000 | 0.68961 | -mx,-my,-mz | -2.50000 | -1.20000 | -1.70000 |
(3/4,1/4,1/2)' + set click here to show and hide |
15 | 0.45783 | 0.25000 | 0.31039 | -mx,-my,-mz | -2.50000 | -1.20000 | -1.70000 |
16 | 0.04217 | 0.25000 | 0.18961 | -mx,-my,-mz | -2.50000 | -1.20000 | -1.70000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom Na1_1:
Atom | x | y | z |
1 | 0.39902 | 0.00000 | 0.11700 |
2 | 0.60098 | 0.00000 | 0.38300 |
(0,1/2,1/2) + set click here to show and hide |
3 | 0.39902 | 0.50000 | 0.61700 |
4 | 0.60098 | 0.50000 | 0.88300 |
(1/2,0,1/2) + set click here to show and hide |
5 | 0.89902 | 0.00000 | 0.61700 |
6 | 0.10098 | 0.00000 | 0.88300 |
(1/2,1/2,0) + set click here to show and hide |
7 | 0.89902 | 0.50000 | 0.11700 |
8 | 0.10098 | 0.50000 | 0.38300 |
(1/4,3/4,1/2)' + set click here to show and hide |
9 | 0.64902 | 0.75000 | 0.61700 |
10 | 0.85098 | 0.75000 | 0.88300 |
(1/4,1/4,0)' + set click here to show and hide |
11 | 0.64902 | 0.25000 | 0.11700 |
12 | 0.85098 | 0.25000 | 0.38300 |
(3/4,3/4,0)' + set click here to show and hide |
13 | 0.14902 | 0.75000 | 0.11700 |
14 | 0.35098 | 0.75000 | 0.38300 |
(3/4,1/4,1/2)' + set click here to show and hide |
15 | 0.14902 | 0.25000 | 0.61700 |
16 | 0.35098 | 0.25000 | 0.88300 |
Set of atoms in the unit cell related by symmetry with the atom Na1_2:
Atom | x | y | z |
1 | 0.60098 | 0.00000 | 0.88300 |
2 | 0.39902 | 0.00000 | 0.61700 |
(0,1/2,1/2) + set click here to show and hide |
3 | 0.60098 | 0.50000 | 0.38300 |
4 | 0.39902 | 0.50000 | 0.11700 |
(1/2,0,1/2) + set click here to show and hide |
5 | 0.10098 | 0.00000 | 0.38300 |
6 | 0.89902 | 0.00000 | 0.11700 |
(1/2,1/2,0) + set click here to show and hide |
7 | 0.10098 | 0.50000 | 0.88300 |
8 | 0.89902 | 0.50000 | 0.61700 |
(1/4,3/4,1/2)' + set click here to show and hide |
9 | 0.85098 | 0.75000 | 0.38300 |
10 | 0.64902 | 0.75000 | 0.11700 |
(1/4,1/4,0)' + set click here to show and hide |
11 | 0.85098 | 0.25000 | 0.88300 |
12 | 0.64902 | 0.25000 | 0.61700 |
(3/4,3/4,0)' + set click here to show and hide |
13 | 0.35098 | 0.75000 | 0.88300 |
14 | 0.14902 | 0.75000 | 0.61700 |
(3/4,1/4,1/2)' + set click here to show and hide |
15 | 0.35098 | 0.25000 | 0.38300 |
16 | 0.14902 | 0.25000 | 0.11700 |
Set of atoms in the unit cell related by symmetry with the atom Se1_1:
Atom | x | y | z |
1 | 0.25000 | 0.00000 | 0.11410 |
2 | 0.75000 | 0.00000 | 0.38590 |
(0,1/2,1/2) + set click here to show and hide |
3 | 0.25000 | 0.50000 | 0.61410 |
4 | 0.75000 | 0.50000 | 0.88590 |
(1/2,0,1/2) + set click here to show and hide |
5 | 0.75000 | 0.00000 | 0.61410 |
6 | 0.25000 | 0.00000 | 0.88590 |
(1/2,1/2,0) + set click here to show and hide |
7 | 0.75000 | 0.50000 | 0.11410 |
8 | 0.25000 | 0.50000 | 0.38590 |
(1/4,3/4,1/2)' + set click here to show and hide |
9 | 0.50000 | 0.75000 | 0.61410 |
10 | 0.00000 | 0.75000 | 0.88590 |
(1/4,1/4,0)' + set click here to show and hide |
11 | 0.50000 | 0.25000 | 0.11410 |
12 | 0.00000 | 0.25000 | 0.38590 |
(3/4,3/4,0)' + set click here to show and hide |
13 | 0.00000 | 0.75000 | 0.11410 |
14 | 0.50000 | 0.75000 | 0.38590 |
(3/4,1/4,1/2)' + set click here to show and hide |
15 | 0.00000 | 0.25000 | 0.61410 |
16 | 0.50000 | 0.25000 | 0.88590 |
Set of atoms in the unit cell related by symmetry with the atom Se1_2:
Atom | x | y | z |
1 | 0.75000 | 0.00000 | 0.88590 |
2 | 0.25000 | 0.00000 | 0.61410 |
(0,1/2,1/2) + set click here to show and hide |
3 | 0.75000 | 0.50000 | 0.38590 |
4 | 0.25000 | 0.50000 | 0.11410 |
(1/2,0,1/2) + set click here to show and hide |
5 | 0.25000 | 0.00000 | 0.38590 |
6 | 0.75000 | 0.00000 | 0.11410 |
(1/2,1/2,0) + set click here to show and hide |
7 | 0.25000 | 0.50000 | 0.88590 |
8 | 0.75000 | 0.50000 | 0.61410 |
(1/4,3/4,1/2)' + set click here to show and hide |
9 | 0.00000 | 0.75000 | 0.38590 |
10 | 0.50000 | 0.75000 | 0.11410 |
(1/4,1/4,0)' + set click here to show and hide |
11 | 0.00000 | 0.25000 | 0.88590 |
12 | 0.50000 | 0.25000 | 0.61410 |
(3/4,3/4,0)' + set click here to show and hide |
13 | 0.50000 | 0.75000 | 0.88590 |
14 | 0.00000 | 0.75000 | 0.61410 |
(3/4,1/4,1/2)' + set click here to show and hide |
15 | 0.50000 | 0.25000 | 0.38590 |
16 | 0.00000 | 0.25000 | 0.11410 |
Set of atoms in the unit cell related by symmetry with the atom Se2_1:
Atom | x | y | z |
1 | 0.08001 | 0.00000 | 0.12265 |
2 | 0.91999 | 0.00000 | 0.37735 |
(0,1/2,1/2) + set click here to show and hide |
3 | 0.08001 | 0.50000 | 0.62265 |
4 | 0.91999 | 0.50000 | 0.87735 |
(1/2,0,1/2) + set click here to show and hide |
5 | 0.58001 | 0.00000 | 0.62265 |
6 | 0.41999 | 0.00000 | 0.87735 |
(1/2,1/2,0) + set click here to show and hide |
7 | 0.58001 | 0.50000 | 0.12265 |
8 | 0.41999 | 0.50000 | 0.37735 |
(1/4,3/4,1/2)' + set click here to show and hide |
9 | 0.33001 | 0.75000 | 0.62265 |
10 | 0.16999 | 0.75000 | 0.87735 |
(1/4,1/4,0)' + set click here to show and hide |
11 | 0.33001 | 0.25000 | 0.12265 |
12 | 0.16999 | 0.25000 | 0.37735 |
(3/4,3/4,0)' + set click here to show and hide |
13 | 0.83001 | 0.75000 | 0.12265 |
14 | 0.66999 | 0.75000 | 0.37735 |
(3/4,1/4,1/2)' + set click here to show and hide |
15 | 0.83001 | 0.25000 | 0.62265 |
16 | 0.66999 | 0.25000 | 0.87735 |
Set of atoms in the unit cell related by symmetry with the atom Se2_2:
Atom | x | y | z |
1 | 0.91999 | 0.00000 | 0.87735 |
2 | 0.08001 | 0.00000 | 0.62265 |
(0,1/2,1/2) + set click here to show and hide |
3 | 0.91999 | 0.50000 | 0.37735 |
4 | 0.08001 | 0.50000 | 0.12265 |
(1/2,0,1/2) + set click here to show and hide |
5 | 0.41999 | 0.00000 | 0.37735 |
6 | 0.58001 | 0.00000 | 0.12265 |
(1/2,1/2,0) + set click here to show and hide |
7 | 0.41999 | 0.50000 | 0.87735 |
8 | 0.58001 | 0.50000 | 0.62265 |
(1/4,3/4,1/2)' + set click here to show and hide |
9 | 0.16999 | 0.75000 | 0.37735 |
10 | 0.33001 | 0.75000 | 0.12265 |
(1/4,1/4,0)' + set click here to show and hide |
11 | 0.16999 | 0.25000 | 0.87735 |
12 | 0.33001 | 0.25000 | 0.62265 |
(3/4,3/4,0)' + set click here to show and hide |
13 | 0.66999 | 0.75000 | 0.87735 |
14 | 0.83001 | 0.75000 | 0.62265 |
(3/4,1/4,1/2)' + set click here to show and hide |
15 | 0.66999 | 0.25000 | 0.37735 |
16 | 0.83001 | 0.25000 | 0.12265 |
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