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 Cr1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.00000 | 0.00000 | 0.50000 | mx,my,mz | 0.00000 | 2.00000 | 0.00000 |
2 | 0.50000 | 0.00000 | 0.00000 | -mx,-my,mz | 0.00000 | -2.00000 | 0.00000 |
3 | 0.50000 | 0.50000 | 0.00000 | -mx,my,mz | 0.00000 | 2.00000 | 0.00000 |
4 | 0.00000 | 0.50000 | 0.50000 | mx,-my,mz | 0.00000 | -2.00000 | 0.00000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom Ca1:
Atom | x | y | z |
1 | 0.03730 | 0.25000 | 0.99140 |
2 | 0.46270 | 0.75000 | 0.49140 |
3 | 0.96270 | 0.75000 | 0.00860 |
4 | 0.53730 | 0.25000 | 0.50860 |
Set of atoms in the unit cell related by symmetry with the atom Pr1:
Atom | x | y | z |
1 | 0.03730 | 0.25000 | 0.99140 |
2 | 0.46270 | 0.75000 | 0.49140 |
3 | 0.96270 | 0.75000 | 0.00860 |
4 | 0.53730 | 0.25000 | 0.50860 |
Set of atoms in the unit cell related by symmetry with the atom Ta1:
Atom | x | y | z |
1 | 0.00000 | 0.00000 | 0.50000 |
2 | 0.50000 | 0.00000 | 0.00000 |
3 | 0.50000 | 0.50000 | 0.00000 |
4 | 0.00000 | 0.50000 | 0.50000 |
Set of atoms in the unit cell related by symmetry with the atom O1:
Atom | x | y | z |
1 | 0.48190 | 0.25000 | 0.07520 |
2 | 0.01810 | 0.75000 | 0.57520 |
3 | 0.51810 | 0.75000 | 0.92480 |
4 | 0.98190 | 0.25000 | 0.42480 |
Set of atoms in the unit cell related by symmetry with the atom O2:
Atom | x | y | z |
1 | 0.20870 | 0.54000 | 0.20730 |
2 | 0.29130 | 0.46000 | 0.70730 |
3 | 0.79130 | 0.46000 | 0.79270 |
4 | 0.70870 | 0.54000 | 0.29270 |
5 | 0.70870 | 0.96000 | 0.29270 |
6 | 0.79130 | 0.04000 | 0.79270 |
7 | 0.29130 | 0.04000 | 0.70730 |
8 | 0.20870 | 0.96000 | 0.20730 |
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