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:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.51679 | 0.12273 | 0.98462 | mx,my,mz | 0.27000 | 2.15000 | -0.27000 |
2 | 0.01679 | 0.37727 | 0.51538 | mx,-my,-mz | 0.27000 | -2.15000 | 0.27000 |
3 | 0.48321 | 0.62273 | 0.01538 | -mx,my,-mz | -0.27000 | 2.15000 | 0.27000 |
4 | 0.98321 | 0.87727 | 0.48462 | -mx,-my,mz | -0.27000 | -2.15000 | -0.27000 |
5 | 0.48321 | 0.87727 | 0.01538 | mx,my,mz | 0.27000 | 2.15000 | -0.27000 |
6 | 0.98321 | 0.62273 | 0.48462 | mx,-my,-mz | 0.27000 | -2.15000 | 0.27000 |
7 | 0.51679 | 0.37727 | 0.98462 | -mx,my,-mz | -0.27000 | 2.15000 | 0.27000 |
8 | 0.01679 | 0.12273 | 0.51538 | -mx,-my,mz | -0.27000 | -2.15000 | -0.27000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom Te1:
Atom | x | y | z |
1 | 0.85151 | 0.48628 | 0.15962 |
2 | 0.35151 | 0.01372 | 0.34038 |
3 | 0.14849 | 0.98628 | 0.84038 |
4 | 0.64849 | 0.51372 | 0.65962 |
5 | 0.14849 | 0.51372 | 0.84038 |
6 | 0.64849 | 0.98628 | 0.65962 |
7 | 0.85151 | 0.01372 | 0.15962 |
8 | 0.35151 | 0.48628 | 0.34038 |
Set of atoms in the unit cell related by symmetry with the atom Te2:
Atom | x | y | z |
1 | 0.10629 | 0.25000 | 0.19652 |
2 | 0.60629 | 0.25000 | 0.30348 |
3 | 0.89371 | 0.75000 | 0.80348 |
4 | 0.39371 | 0.75000 | 0.69652 |
Set of atoms in the unit cell related by symmetry with the atom Te3:
Atom | x | y | z |
1 | 0.33474 | 0.25000 | 0.68169 |
2 | 0.83474 | 0.25000 | 0.81831 |
3 | 0.66526 | 0.75000 | 0.31831 |
4 | 0.16526 | 0.75000 | 0.18169 |
Set of atoms in the unit cell related by symmetry with the atom O1:
Atom | x | y | z |
1 | 0.12569 | 0.25000 | 0.66773 |
2 | 0.62569 | 0.25000 | 0.83227 |
3 | 0.87431 | 0.75000 | 0.33227 |
4 | 0.37431 | 0.75000 | 0.16773 |
Set of atoms in the unit cell related by symmetry with the atom O2:
Atom | x | y | z |
1 | 0.45826 | 0.25000 | 0.12455 |
2 | 0.95826 | 0.25000 | 0.37545 |
3 | 0.54174 | 0.75000 | 0.87545 |
4 | 0.04174 | 0.75000 | 0.62455 |
Set of atoms in the unit cell related by symmetry with the atom O3:
Atom | x | y | z |
1 | 0.48597 | 0.13537 | 0.40877 |
2 | 0.98597 | 0.36463 | 0.09123 |
3 | 0.51403 | 0.63537 | 0.59123 |
4 | 0.01403 | 0.86463 | 0.90877 |
5 | 0.51403 | 0.86463 | 0.59123 |
6 | 0.01403 | 0.63537 | 0.90877 |
7 | 0.48597 | 0.36463 | 0.40877 |
8 | 0.98597 | 0.13537 | 0.09123 |
Set of atoms in the unit cell related by symmetry with the atom O4:
Atom | x | y | z |
1 | 0.68765 | 0.10950 | 0.14059 |
2 | 0.18765 | 0.39050 | 0.35941 |
3 | 0.31235 | 0.60950 | 0.85941 |
4 | 0.81235 | 0.89050 | 0.64059 |
5 | 0.31235 | 0.89050 | 0.85941 |
6 | 0.81235 | 0.60950 | 0.64059 |
7 | 0.68765 | 0.39050 | 0.14059 |
8 | 0.18765 | 0.10950 | 0.35941 |
Set of atoms in the unit cell related by symmetry with the atom O5:
Atom | x | y | z |
1 | 0.38428 | 0.48515 | 0.11526 |
2 | 0.88428 | 0.01485 | 0.38474 |
3 | 0.61572 | 0.98515 | 0.88474 |
4 | 0.11572 | 0.51485 | 0.61526 |
5 | 0.61572 | 0.51485 | 0.88474 |
6 | 0.11572 | 0.98515 | 0.61526 |
7 | 0.38428 | 0.01485 | 0.11526 |
8 | 0.88428 | 0.48515 | 0.38474 |
Set of atoms in the unit cell related by symmetry with the atom O6:
Atom | x | y | z |
1 | 0.34407 | 0.12771 | 0.82248 |
2 | 0.84407 | 0.37229 | 0.67752 |
3 | 0.65593 | 0.62771 | 0.17752 |
4 | 0.15593 | 0.87229 | 0.32248 |
5 | 0.65593 | 0.87229 | 0.17752 |
6 | 0.15593 | 0.62771 | 0.32248 |
7 | 0.34407 | 0.37229 | 0.82248 |
8 | 0.84407 | 0.12771 | 0.67752 |
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