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 Ru1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.00000 | 0.33333 | 0.16556 | mx,my,mz | -1.30000 | 0.00000 | -0.60000 |
2 | 0.50000 | 0.83333 | 0.33444 | -mx,my,-mz | 1.30000 | 0.00000 | 0.60000 |
3 | 0.00000 | 0.66667 | 0.83444 | mx,my,mz | -1.30000 | 0.00000 | -0.60000 |
4 | 0.50000 | 0.16667 | 0.66556 | -mx,my,-mz | 1.30000 | 0.00000 | 0.60000 |
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5 | 0.50000 | 0.83333 | 0.16556 | -mx,-my,-mz | 1.30000 | 0.00000 | 0.60000 |
6 | 0.00000 | 0.33333 | 0.33444 | mx,-my,mz | -1.30000 | 0.00000 | -0.60000 |
7 | 0.50000 | 0.16667 | 0.83444 | -mx,-my,-mz | 1.30000 | 0.00000 | 0.60000 |
8 | 0.00000 | 0.66667 | 0.66556 | mx,-my,mz | -1.30000 | 0.00000 | -0.60000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom Ba1:
Atom | x | y | z |
1 | 0.00000 | 0.00000 | 0.25000 |
2 | 0.00000 | 0.00000 | 0.75000 |
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3 | 0.50000 | 0.50000 | 0.25000 |
4 | 0.50000 | 0.50000 | 0.75000 |
Set of atoms in the unit cell related by symmetry with the atom Ba2:
Atom | x | y | z |
1 | 0.00000 | 0.33333 | 0.89090 |
2 | 0.50000 | 0.83333 | 0.60910 |
3 | 0.00000 | 0.66667 | 0.10910 |
4 | 0.50000 | 0.16667 | 0.39090 |
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5 | 0.50000 | 0.83333 | 0.89090 |
6 | 0.00000 | 0.33333 | 0.60910 |
7 | 0.50000 | 0.16667 | 0.10910 |
8 | 0.00000 | 0.66667 | 0.39090 |
Set of atoms in the unit cell related by symmetry with the atom La1:
Atom | x | y | z |
1 | 0.00000 | 0.00000 | 0.00000 |
2 | 0.50000 | 0.50000 | 0.50000 |
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3 | 0.50000 | 0.50000 | 0.00000 |
4 | 0.00000 | 0.00000 | 0.50000 |
Set of atoms in the unit cell related by symmetry with the atom O1_1:
Atom | x | y | z |
1 | 0.00000 | 0.48730 | 0.25000 |
2 | 0.00000 | 0.51270 | 0.75000 |
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3 | 0.50000 | 0.98730 | 0.25000 |
4 | 0.50000 | 0.01270 | 0.75000 |
Set of atoms in the unit cell related by symmetry with the atom O1_2:
Atom | x | y | z |
1 | 0.26905 | 0.75635 | 0.25000 |
2 | 0.23095 | 0.25635 | 0.25000 |
3 | 0.73095 | 0.24365 | 0.75000 |
4 | 0.76905 | 0.74365 | 0.75000 |
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5 | 0.76905 | 0.25635 | 0.25000 |
6 | 0.73095 | 0.75635 | 0.25000 |
7 | 0.23095 | 0.74365 | 0.75000 |
8 | 0.26905 | 0.24365 | 0.75000 |
Set of atoms in the unit cell related by symmetry with the atom O2_1:
Atom | x | y | z |
1 | 0.00000 | 0.17889 | 0.40471 |
2 | 0.50000 | 0.67889 | 0.09529 |
3 | 0.00000 | 0.82111 | 0.59529 |
4 | 0.50000 | 0.32111 | 0.90471 |
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5 | 0.50000 | 0.67889 | 0.40471 |
6 | 0.00000 | 0.17889 | 0.09529 |
7 | 0.50000 | 0.32111 | 0.59529 |
8 | 0.00000 | 0.82111 | 0.90471 |
Set of atoms in the unit cell related by symmetry with the atom O2_2:
Atom | x | y | z |
1 | 0.73166 | 0.91056 | 0.40471 |
2 | 0.76834 | 0.41056 | 0.09529 |
3 | 0.26834 | 0.08944 | 0.59529 |
4 | 0.23166 | 0.58944 | 0.90471 |
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5 | 0.23166 | 0.41056 | 0.40471 |
6 | 0.26834 | 0.91056 | 0.09529 |
7 | 0.76834 | 0.58944 | 0.59529 |
8 | 0.73166 | 0.08944 | 0.90471 |
Set of atoms in the unit cell related by symmetry with the atom O2_3:
Atom | x | y | z |
1 | 0.26833 | 0.91056 | 0.40471 |
2 | 0.23167 | 0.41056 | 0.09529 |
3 | 0.73167 | 0.08944 | 0.59529 |
4 | 0.76833 | 0.58944 | 0.90471 |
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5 | 0.76833 | 0.41056 | 0.40471 |
6 | 0.73167 | 0.91056 | 0.09529 |
7 | 0.23167 | 0.58944 | 0.59529 |
8 | 0.26833 | 0.08944 | 0.90471 |
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