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 | 0.66420 | 0.50910 | 0.81360 | mx,my,mz | 0.00000 | 0.51000 | 1.49000 |
2 | 0.16420 | 0.99090 | 0.18640 | mx,-my,-mz | 0.00000 | -0.51000 | -1.49000 |
3 | 0.33580 | 0.50910 | 0.68640 | -mx,my,-mz | 0.00000 | 0.51000 | -1.49000 |
4 | 0.83580 | 0.99090 | 0.31360 | -mx,-my,mz | 0.00000 | -0.51000 | 1.49000 |
5 | 0.33580 | 0.49090 | 0.18640 | -mx,-my,-mz | 0.00000 | -0.51000 | -1.49000 |
6 | 0.83580 | 0.00910 | 0.81360 | -mx,my,mz | 0.00000 | 0.51000 | 1.49000 |
7 | 0.66420 | 0.49090 | 0.31360 | mx,-my,mz | 0.00000 | -0.51000 | 1.49000 |
8 | 0.16420 | 0.00910 | 0.68640 | mx,my,-mz | 0.00000 | 0.51000 | -1.49000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom W1:
Atom | x | y | z |
1 | 0.52450 | 0.00397 | 0.64489 |
2 | 0.02450 | 0.49603 | 0.35511 |
3 | 0.47550 | 0.00397 | 0.85511 |
4 | 0.97550 | 0.49603 | 0.14489 |
5 | 0.47550 | 0.99603 | 0.35511 |
6 | 0.97550 | 0.50397 | 0.64489 |
7 | 0.52450 | 0.99603 | 0.14489 |
8 | 0.02450 | 0.50397 | 0.85511 |
Set of atoms in the unit cell related by symmetry with the atom O1:
Atom | x | y | z |
1 | 0.50000 | 0.28622 | 0.75000 |
2 | 0.00000 | 0.21378 | 0.25000 |
3 | 0.50000 | 0.71378 | 0.25000 |
4 | 0.00000 | 0.78622 | 0.75000 |
Set of atoms in the unit cell related by symmetry with the atom O2:
Atom | x | y | z |
1 | 0.50499 | 0.67724 | 0.90756 |
2 | 0.00499 | 0.82276 | 0.09244 |
3 | 0.49501 | 0.67724 | 0.59244 |
4 | 0.99501 | 0.82276 | 0.40756 |
5 | 0.49501 | 0.32276 | 0.09244 |
6 | 0.99501 | 0.17724 | 0.90756 |
7 | 0.50499 | 0.32276 | 0.40756 |
8 | 0.00499 | 0.17724 | 0.59244 |
Set of atoms in the unit cell related by symmetry with the atom O3:
Atom | x | y | z |
1 | 0.64784 | 0.85224 | 0.74746 |
2 | 0.14784 | 0.64776 | 0.25254 |
3 | 0.35216 | 0.85224 | 0.75254 |
4 | 0.85216 | 0.64776 | 0.24746 |
5 | 0.35216 | 0.14776 | 0.25254 |
6 | 0.85216 | 0.35224 | 0.74746 |
7 | 0.64784 | 0.14776 | 0.24746 |
8 | 0.14784 | 0.35224 | 0.75254 |
Set of atoms in the unit cell related by symmetry with the atom O4:
Atom | x | y | z |
1 | 0.84146 | 0.66429 | 0.89751 |
2 | 0.34146 | 0.83571 | 0.10249 |
3 | 0.15854 | 0.66429 | 0.60249 |
4 | 0.65854 | 0.83571 | 0.39751 |
5 | 0.15854 | 0.33571 | 0.10249 |
6 | 0.65854 | 0.16429 | 0.89751 |
7 | 0.84146 | 0.33571 | 0.39751 |
8 | 0.34146 | 0.16429 | 0.60249 |
Set of atoms in the unit cell related by symmetry with the atom O5:
Atom | x | y | z |
1 | 0.34221 | 0.15590 | 0.92766 |
2 | 0.84221 | 0.34410 | 0.07234 |
3 | 0.65779 | 0.15590 | 0.57234 |
4 | 0.15779 | 0.34410 | 0.42766 |
5 | 0.65779 | 0.84410 | 0.07234 |
6 | 0.15779 | 0.65590 | 0.92766 |
7 | 0.34221 | 0.84410 | 0.42766 |
8 | 0.84221 | 0.65590 | 0.57234 |
Set of atoms in the unit cell related by symmetry with the atom Li1:
Atom | x | y | z |
1 | 0.33096 | 0.45705 | 0.49140 |
2 | 0.83096 | 0.04295 | 0.50860 |
3 | 0.66904 | 0.45705 | 0.00860 |
4 | 0.16904 | 0.04295 | 0.99140 |
5 | 0.66904 | 0.54295 | 0.50860 |
6 | 0.16904 | 0.95705 | 0.49140 |
7 | 0.33096 | 0.54295 | 0.99140 |
8 | 0.83096 | 0.95705 | 0.00860 |
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