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 Ni1_1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.00000 | 0.00000 | 0.00000 | 0,my,mz | 0.00000 | -1.60000 | 0.00000 |
2 | 0.50000 | 0.25000 | 0.00000 | 0,-my,mz | 0.00000 | 1.60000 | 0.00000 |
(0,1/2,1/2) + set click here to show and hide |
3 | 0.00000 | 0.50000 | 0.50000 | 0,my,mz | 0.00000 | -1.60000 | 0.00000 |
4 | 0.50000 | 0.75000 | 0.50000 | 0,-my,mz | 0.00000 | 1.60000 | 0.00000 |
(0,0,1/2)' + set click here to show and hide |
5 | 0.00000 | 0.00000 | 0.50000 | 0,-my,-mz | 0.00000 | 1.60000 | 0.00000 |
6 | 0.50000 | 0.25000 | 0.50000 | 0,my,-mz | 0.00000 | -1.60000 | 0.00000 |
(0,1/2,0)' + set click here to show and hide |
7 | 0.00000 | 0.50000 | 0.00000 | 0,-my,-mz | 0.00000 | 1.60000 | 0.00000 |
8 | 0.50000 | 0.75000 | 0.00000 | 0,my,-mz | 0.00000 | -1.60000 | 0.00000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Ni1_2:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.00000 | 0.25000 | 0.25000 | 0,my,mz | 0.00000 | 1.60000 | 0.00000 |
2 | 0.50000 | 0.00000 | 0.25000 | 0,-my,mz | 0.00000 | -1.60000 | 0.00000 |
(0,1/2,1/2) + set click here to show and hide |
3 | 0.00000 | 0.75000 | 0.75000 | 0,my,mz | 0.00000 | 1.60000 | 0.00000 |
4 | 0.50000 | 0.50000 | 0.75000 | 0,-my,mz | 0.00000 | -1.60000 | 0.00000 |
(0,0,1/2)' + set click here to show and hide |
5 | 0.00000 | 0.25000 | 0.75000 | 0,-my,-mz | 0.00000 | -1.60000 | 0.00000 |
6 | 0.50000 | 0.00000 | 0.75000 | 0,my,-mz | 0.00000 | 1.60000 | 0.00000 |
(0,1/2,0)' + set click here to show and hide |
7 | 0.00000 | 0.75000 | 0.25000 | 0,-my,-mz | 0.00000 | -1.60000 | 0.00000 |
8 | 0.50000 | 0.50000 | 0.25000 | 0,my,-mz | 0.00000 | 1.60000 | 0.00000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom Ta1_1:
Atom | x | y | z |
1 | 0.00000 | 0.00000 | 0.16580 |
2 | 0.50000 | 0.25000 | 0.16580 |
(0,1/2,1/2) + set click here to show and hide |
3 | 0.00000 | 0.50000 | 0.66580 |
4 | 0.50000 | 0.75000 | 0.66580 |
(0,0,1/2)' + set click here to show and hide |
5 | 0.00000 | 0.00000 | 0.66580 |
6 | 0.50000 | 0.25000 | 0.66580 |
(0,1/2,0)' + set click here to show and hide |
7 | 0.00000 | 0.50000 | 0.16580 |
8 | 0.50000 | 0.75000 | 0.16580 |
Set of atoms in the unit cell related by symmetry with the atom Ta1_2:
Atom | x | y | z |
1 | 0.00000 | 0.25000 | 0.41580 |
2 | 0.50000 | 0.00000 | 0.41580 |
(0,1/2,1/2) + set click here to show and hide |
3 | 0.00000 | 0.75000 | 0.91580 |
4 | 0.50000 | 0.50000 | 0.91580 |
(0,0,1/2)' + set click here to show and hide |
5 | 0.00000 | 0.25000 | 0.91580 |
6 | 0.50000 | 0.00000 | 0.91580 |
(0,1/2,0)' + set click here to show and hide |
7 | 0.00000 | 0.75000 | 0.41580 |
8 | 0.50000 | 0.50000 | 0.41580 |
Set of atoms in the unit cell related by symmetry with the atom Ta1_3:
Atom | x | y | z |
1 | 0.00000 | 0.25000 | 0.08420 |
2 | 0.50000 | 0.00000 | 0.08420 |
(0,1/2,1/2) + set click here to show and hide |
3 | 0.00000 | 0.75000 | 0.58420 |
4 | 0.50000 | 0.50000 | 0.58420 |
(0,0,1/2)' + set click here to show and hide |
5 | 0.00000 | 0.25000 | 0.58420 |
6 | 0.50000 | 0.00000 | 0.58420 |
(0,1/2,0)' + set click here to show and hide |
7 | 0.00000 | 0.75000 | 0.08420 |
8 | 0.50000 | 0.50000 | 0.08420 |
Set of atoms in the unit cell related by symmetry with the atom Ta1_4:
Atom | x | y | z |
1 | 0.00000 | 0.00000 | 0.83420 |
2 | 0.50000 | 0.25000 | 0.83420 |
(0,1/2,1/2) + set click here to show and hide |
3 | 0.00000 | 0.50000 | 0.33420 |
4 | 0.50000 | 0.75000 | 0.33420 |
(0,0,1/2)' + set click here to show and hide |
5 | 0.00000 | 0.00000 | 0.33420 |
6 | 0.50000 | 0.25000 | 0.33420 |
(0,1/2,0)' + set click here to show and hide |
7 | 0.00000 | 0.50000 | 0.83420 |
8 | 0.50000 | 0.75000 | 0.83420 |
Set of atoms in the unit cell related by symmetry with the atom O1_1:
Atom | x | y | z |
1 | 0.00000 | 0.15350 | 0.00000 |
2 | 0.50000 | 0.09650 | 0.00000 |
(0,1/2,1/2) + set click here to show and hide |
3 | 0.00000 | 0.65350 | 0.50000 |
4 | 0.50000 | 0.59650 | 0.50000 |
(0,0,1/2)' + set click here to show and hide |
5 | 0.00000 | 0.15350 | 0.50000 |
6 | 0.50000 | 0.09650 | 0.50000 |
(0,1/2,0)' + set click here to show and hide |
7 | 0.00000 | 0.65350 | 0.00000 |
8 | 0.50000 | 0.59650 | 0.00000 |
Set of atoms in the unit cell related by symmetry with the atom O1_2:
Atom | x | y | z |
1 | 0.00000 | 0.84650 | 0.00000 |
2 | 0.50000 | 0.40350 | 0.00000 |
(0,1/2,1/2) + set click here to show and hide |
3 | 0.00000 | 0.34650 | 0.50000 |
4 | 0.50000 | 0.90350 | 0.50000 |
(0,0,1/2)' + set click here to show and hide |
5 | 0.00000 | 0.84650 | 0.50000 |
6 | 0.50000 | 0.40350 | 0.50000 |
(0,1/2,0)' + set click here to show and hide |
7 | 0.00000 | 0.34650 | 0.00000 |
8 | 0.50000 | 0.90350 | 0.00000 |
Set of atoms in the unit cell related by symmetry with the atom O1_3:
Atom | x | y | z |
1 | 0.69300 | 0.25000 | 0.25000 |
2 | 0.80700 | 0.00000 | 0.25000 |
3 | 0.30700 | 0.25000 | 0.75000 |
4 | 0.19300 | 0.00000 | 0.75000 |
(0,1/2,1/2) + set click here to show and hide |
5 | 0.69300 | 0.75000 | 0.75000 |
6 | 0.80700 | 0.50000 | 0.75000 |
7 | 0.30700 | 0.75000 | 0.25000 |
8 | 0.19300 | 0.50000 | 0.25000 |
(0,0,1/2)' + set click here to show and hide |
9 | 0.69300 | 0.25000 | 0.75000 |
10 | 0.80700 | 0.00000 | 0.75000 |
11 | 0.30700 | 0.25000 | 0.25000 |
12 | 0.19300 | 0.00000 | 0.25000 |
(0,1/2,0)' + set click here to show and hide |
13 | 0.69300 | 0.75000 | 0.25000 |
14 | 0.80700 | 0.50000 | 0.25000 |
15 | 0.30700 | 0.75000 | 0.75000 |
16 | 0.19300 | 0.50000 | 0.75000 |
Set of atoms in the unit cell related by symmetry with the atom O2_1:
Atom | x | y | z |
1 | 0.00000 | 0.14850 | 0.16350 |
2 | 0.50000 | 0.10150 | 0.16350 |
(0,1/2,1/2) + set click here to show and hide |
3 | 0.00000 | 0.64850 | 0.66350 |
4 | 0.50000 | 0.60150 | 0.66350 |
(0,0,1/2)' + set click here to show and hide |
5 | 0.00000 | 0.14850 | 0.66350 |
6 | 0.50000 | 0.10150 | 0.66350 |
(0,1/2,0)' + set click here to show and hide |
7 | 0.00000 | 0.64850 | 0.16350 |
8 | 0.50000 | 0.60150 | 0.16350 |
Set of atoms in the unit cell related by symmetry with the atom O2_2:
Atom | x | y | z |
1 | 0.00000 | 0.85150 | 0.16350 |
2 | 0.50000 | 0.39850 | 0.16350 |
(0,1/2,1/2) + set click here to show and hide |
3 | 0.00000 | 0.35150 | 0.66350 |
4 | 0.50000 | 0.89850 | 0.66350 |
(0,0,1/2)' + set click here to show and hide |
5 | 0.00000 | 0.85150 | 0.66350 |
6 | 0.50000 | 0.39850 | 0.66350 |
(0,1/2,0)' + set click here to show and hide |
7 | 0.00000 | 0.35150 | 0.16350 |
8 | 0.50000 | 0.89850 | 0.16350 |
Set of atoms in the unit cell related by symmetry with the atom O2_3:
Atom | x | y | z |
1 | 0.70300 | 0.25000 | 0.41350 |
2 | 0.79700 | 0.00000 | 0.41350 |
3 | 0.29700 | 0.25000 | 0.91350 |
4 | 0.20300 | 0.00000 | 0.91350 |
(0,1/2,1/2) + set click here to show and hide |
5 | 0.70300 | 0.75000 | 0.91350 |
6 | 0.79700 | 0.50000 | 0.91350 |
7 | 0.29700 | 0.75000 | 0.41350 |
8 | 0.20300 | 0.50000 | 0.41350 |
(0,0,1/2)' + set click here to show and hide |
9 | 0.70300 | 0.25000 | 0.91350 |
10 | 0.79700 | 0.00000 | 0.91350 |
11 | 0.29700 | 0.25000 | 0.41350 |
12 | 0.20300 | 0.00000 | 0.41350 |
(0,1/2,0)' + set click here to show and hide |
13 | 0.70300 | 0.75000 | 0.41350 |
14 | 0.79700 | 0.50000 | 0.41350 |
15 | 0.29700 | 0.75000 | 0.91350 |
16 | 0.20300 | 0.50000 | 0.91350 |
Set of atoms in the unit cell related by symmetry with the atom O2_4:
Atom | x | y | z |
1 | 0.70300 | 0.25000 | 0.08650 |
2 | 0.79700 | 0.00000 | 0.08650 |
3 | 0.29700 | 0.25000 | 0.58650 |
4 | 0.20300 | 0.00000 | 0.58650 |
(0,1/2,1/2) + set click here to show and hide |
5 | 0.70300 | 0.75000 | 0.58650 |
6 | 0.79700 | 0.50000 | 0.58650 |
7 | 0.29700 | 0.75000 | 0.08650 |
8 | 0.20300 | 0.50000 | 0.08650 |
(0,0,1/2)' + set click here to show and hide |
9 | 0.70300 | 0.25000 | 0.58650 |
10 | 0.79700 | 0.00000 | 0.58650 |
11 | 0.29700 | 0.25000 | 0.08650 |
12 | 0.20300 | 0.00000 | 0.08650 |
(0,1/2,0)' + set click here to show and hide |
13 | 0.70300 | 0.75000 | 0.08650 |
14 | 0.79700 | 0.50000 | 0.08650 |
15 | 0.29700 | 0.75000 | 0.58650 |
16 | 0.20300 | 0.50000 | 0.58650 |
Set of atoms in the unit cell related by symmetry with the atom O2_5:
Atom | x | y | z |
1 | 0.00000 | 0.14850 | 0.83650 |
2 | 0.50000 | 0.10150 | 0.83650 |
(0,1/2,1/2) + set click here to show and hide |
3 | 0.00000 | 0.64850 | 0.33650 |
4 | 0.50000 | 0.60150 | 0.33650 |
(0,0,1/2)' + set click here to show and hide |
5 | 0.00000 | 0.14850 | 0.33650 |
6 | 0.50000 | 0.10150 | 0.33650 |
(0,1/2,0)' + set click here to show and hide |
7 | 0.00000 | 0.64850 | 0.83650 |
8 | 0.50000 | 0.60150 | 0.83650 |
Set of atoms in the unit cell related by symmetry with the atom O2_6:
Atom | x | y | z |
1 | 0.00000 | 0.85150 | 0.83650 |
2 | 0.50000 | 0.39850 | 0.83650 |
(0,1/2,1/2) + set click here to show and hide |
3 | 0.00000 | 0.35150 | 0.33650 |
4 | 0.50000 | 0.89850 | 0.33650 |
(0,0,1/2)' + set click here to show and hide |
5 | 0.00000 | 0.85150 | 0.33650 |
6 | 0.50000 | 0.39850 | 0.33650 |
(0,1/2,0)' + set click here to show and hide |
7 | 0.00000 | 0.35150 | 0.83650 |
8 | 0.50000 | 0.89850 | 0.83650 |
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