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 Co1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.33333 | 0.66667 | 0.19186 | mx,my,mz | -0.73000 | 2.30000 | 0.00000 |
2 | 0.33333 | 0.66666 | 0.69186 | -mx,-mx+my,-mz | 0.73000 | 3.03000 | 0.00000 |
3 | 0.66667 | 0.33334 | 0.30814 | mx,mx-my,mz | -0.73000 | -3.03000 | 0.00000 |
4 | 0.66667 | 0.33333 | 0.80814 | -mx,-my,-mz | 0.73000 | -2.30000 | 0.00000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Co2:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.33333 | 0.66667 | 0.98604 | mx,my,mz | 0.73000 | 2.30000 | 0.00000 |
2 | 0.33333 | 0.66666 | 0.48604 | -mx,-mx+my,-mz | -0.73000 | 1.57000 | 0.00000 |
3 | 0.66667 | 0.33334 | 0.51396 | mx,mx-my,mz | 0.73000 | -1.57000 | 0.00000 |
4 | 0.66667 | 0.33333 | 0.01396 | -mx,-my,-mz | -0.73000 | -2.30000 | 0.00000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom Ta1:
Atom | x | y | z |
1 | 0.00000 | 0.00000 | 0.14280 |
2 | 0.00000 | 0.00000 | 0.64280 |
3 | 0.00000 | 0.00000 | 0.35720 |
4 | 0.00000 | 0.00000 | 0.85720 |
Set of atoms in the unit cell related by symmetry with the atom O1_1:
Atom | x | y | z |
1 | 0.28700 | 0.00000 | 0.25000 |
2 | 0.28700 | 0.28700 | 0.75000 |
3 | 0.71300 | 0.71300 | 0.25000 |
4 | 0.71300 | 0.00000 | 0.75000 |
Set of atoms in the unit cell related by symmetry with the atom O1_2:
Atom | x | y | z |
1 | 0.00000 | 0.28700 | 0.25000 |
2 | 0.00000 | 0.71300 | 0.75000 |
Set of atoms in the unit cell related by symmetry with the atom O2_1:
Atom | x | y | z |
1 | 0.02300 | 0.68140 | 0.08440 |
2 | 0.02300 | 0.34160 | 0.58440 |
3 | 0.97700 | 0.65840 | 0.41560 |
4 | 0.97700 | 0.31860 | 0.91560 |
Set of atoms in the unit cell related by symmetry with the atom O2_2:
Atom | x | y | z |
1 | 0.31860 | 0.34160 | 0.08440 |
2 | 0.31860 | 0.97700 | 0.58440 |
3 | 0.68140 | 0.02300 | 0.41560 |
4 | 0.68140 | 0.65840 | 0.91560 |
Set of atoms in the unit cell related by symmetry with the atom O2_3:
Atom | x | y | z |
1 | 0.65840 | 0.97700 | 0.08440 |
2 | 0.65840 | 0.68140 | 0.58440 |
3 | 0.34160 | 0.31860 | 0.41560 |
4 | 0.34160 | 0.02300 | 0.91560 |
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