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 Fe1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.02150 | 0.25000 | 0.31410 | 0,my,0 | 0.00000 | -0.48000 | 0.00000 |
2 | 0.52150 | 0.25000 | 0.18590 | 0,-my,0 | 0.00000 | 0.48000 | 0.00000 |
3 | 0.97850 | 0.75000 | 0.68590 | 0,-my,0 | 0.00000 | 0.48000 | 0.00000 |
4 | 0.47850 | 0.75000 | 0.81410 | 0,my,0 | 0.00000 | -0.48000 | 0.00000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Fe2:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.06610 | 0.25000 | 0.53830 | 0,my,0 | 0.00000 | 0.46000 | 0.00000 |
2 | 0.56610 | 0.25000 | 0.96170 | 0,-my,0 | 0.00000 | -0.46000 | 0.00000 |
3 | 0.93390 | 0.75000 | 0.46170 | 0,-my,0 | 0.00000 | -0.46000 | 0.00000 |
4 | 0.43390 | 0.75000 | 0.03830 | 0,my,0 | 0.00000 | 0.46000 | 0.00000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Fe3:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.30510 | 0.25000 | 0.12210 | 0,my,0 | 0.00000 | 1.71000 | 0.00000 |
2 | 0.80510 | 0.25000 | 0.37790 | 0,-my,0 | 0.00000 | -1.71000 | 0.00000 |
3 | 0.69490 | 0.75000 | 0.87790 | 0,-my,0 | 0.00000 | -1.71000 | 0.00000 |
4 | 0.19490 | 0.75000 | 0.62210 | 0,my,0 | 0.00000 | 1.71000 | 0.00000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Fe4:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.31550 | 0.25000 | 0.72310 | 0,my,0 | 0.00000 | 1.58000 | 0.00000 |
2 | 0.81550 | 0.25000 | 0.77690 | 0,-my,0 | 0.00000 | -1.58000 | 0.00000 |
3 | 0.68450 | 0.75000 | 0.27690 | 0,-my,0 | 0.00000 | -1.58000 | 0.00000 |
4 | 0.18450 | 0.75000 | 0.22310 | 0,my,0 | 0.00000 | 1.58000 | 0.00000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom Cr1:
Atom | x | y | z |
1 | 0.02150 | 0.25000 | 0.31410 |
2 | 0.52150 | 0.25000 | 0.18590 |
3 | 0.97850 | 0.75000 | 0.68590 |
4 | 0.47850 | 0.75000 | 0.81410 |
Set of atoms in the unit cell related by symmetry with the atom Ca1:
Atom | x | y | z |
1 | 0.33817 | 0.25000 | 0.43050 |
2 | 0.83817 | 0.25000 | 0.06950 |
3 | 0.66183 | 0.75000 | 0.56950 |
4 | 0.16183 | 0.75000 | 0.93050 |
Set of atoms in the unit cell related by symmetry with the atom As1:
Atom | x | y | z |
1 | 0.36728 | 0.25000 | 0.92156 |
2 | 0.86728 | 0.25000 | 0.57844 |
3 | 0.63272 | 0.75000 | 0.07844 |
4 | 0.13272 | 0.75000 | 0.42156 |
Set of atoms in the unit cell related by symmetry with the atom As2:
Atom | x | y | z |
1 | 0.11435 | 0.25000 | 0.73819 |
2 | 0.61435 | 0.25000 | 0.76181 |
3 | 0.88565 | 0.75000 | 0.26181 |
4 | 0.38565 | 0.75000 | 0.23819 |
Set of atoms in the unit cell related by symmetry with the atom As3:
Atom | x | y | z |
1 | 0.10028 | 0.25000 | 0.11972 |
2 | 0.60028 | 0.25000 | 0.38028 |
3 | 0.89972 | 0.75000 | 0.88028 |
4 | 0.39972 | 0.75000 | 0.61972 |
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