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 Cu1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.16551 | 0.36460 | 0.75200 | mx,my,mz | 0.93000 | 0.00000 | 0.00000 |
2 | 0.83449 | 0.63540 | 0.75200 | -mx,-my,mz | -0.93000 | 0.00000 | 0.00000 |
3 | 0.08449 | 0.61460 | 0.00200 | -mx,my,mz | -0.93000 | 0.00000 | 0.00000 |
4 | 0.41551 | 0.88540 | 0.00200 | mx,-my,mz | 0.93000 | 0.00000 | 0.00000 |
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5 | 0.16551 | 0.86460 | 0.25200 | mx,my,mz | 0.93000 | 0.00000 | 0.00000 |
6 | 0.83449 | 0.13540 | 0.25200 | -mx,-my,mz | -0.93000 | 0.00000 | 0.00000 |
7 | 0.08449 | 0.11460 | 0.50200 | -mx,my,mz | -0.93000 | 0.00000 | 0.00000 |
8 | 0.41551 | 0.38540 | 0.50200 | mx,-my,mz | 0.93000 | 0.00000 | 0.00000 |
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9 | 0.66551 | 0.36460 | 0.25200 | mx,my,mz | 0.93000 | 0.00000 | 0.00000 |
10 | 0.33449 | 0.63540 | 0.25200 | -mx,-my,mz | -0.93000 | 0.00000 | 0.00000 |
11 | 0.58449 | 0.61460 | 0.50200 | -mx,my,mz | -0.93000 | 0.00000 | 0.00000 |
12 | 0.91551 | 0.88540 | 0.50200 | mx,-my,mz | 0.93000 | 0.00000 | 0.00000 |
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13 | 0.66551 | 0.86460 | 0.75200 | mx,my,mz | 0.93000 | 0.00000 | 0.00000 |
14 | 0.33449 | 0.13540 | 0.75200 | -mx,-my,mz | -0.93000 | 0.00000 | 0.00000 |
15 | 0.58449 | 0.11460 | 0.00200 | -mx,my,mz | -0.93000 | 0.00000 | 0.00000 |
16 | 0.91551 | 0.38540 | 0.00200 | mx,-my,mz | 0.93000 | 0.00000 | 0.00000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom V1:
Atom | x | y | z |
1 | 0.19900 | 0.40460 | 0.23700 |
2 | 0.80100 | 0.59540 | 0.23700 |
3 | 0.05100 | 0.65460 | 0.48700 |
4 | 0.44900 | 0.84540 | 0.48700 |
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5 | 0.19900 | 0.90460 | 0.73700 |
6 | 0.80100 | 0.09540 | 0.73700 |
7 | 0.05100 | 0.15460 | 0.98700 |
8 | 0.44900 | 0.34540 | 0.98700 |
(1/2,0,1/2) + set click here to show and hide |
9 | 0.69900 | 0.40460 | 0.73700 |
10 | 0.30100 | 0.59540 | 0.73700 |
11 | 0.55100 | 0.65460 | 0.98700 |
12 | 0.94900 | 0.84540 | 0.98700 |
(1/2,1/2,0) + set click here to show and hide |
13 | 0.69900 | 0.90460 | 0.23700 |
14 | 0.30100 | 0.09540 | 0.23700 |
15 | 0.55100 | 0.15460 | 0.48700 |
16 | 0.94900 | 0.34540 | 0.48700 |
Set of atoms in the unit cell related by symmetry with the atom O1:
Atom | x | y | z |
1 | 0.24605 | 0.56165 | 0.27230 |
2 | 0.75395 | 0.43835 | 0.27230 |
3 | 0.00395 | 0.81165 | 0.52230 |
4 | 0.49605 | 0.68835 | 0.52230 |
(0,1/2,1/2) + set click here to show and hide |
5 | 0.24605 | 0.06165 | 0.77230 |
6 | 0.75395 | 0.93835 | 0.77230 |
7 | 0.00395 | 0.31165 | 0.02230 |
8 | 0.49605 | 0.18835 | 0.02230 |
(1/2,0,1/2) + set click here to show and hide |
9 | 0.74605 | 0.56165 | 0.77230 |
10 | 0.25395 | 0.43835 | 0.77230 |
11 | 0.50395 | 0.81165 | 0.02230 |
12 | 0.99605 | 0.68835 | 0.02230 |
(1/2,1/2,0) + set click here to show and hide |
13 | 0.74605 | 0.06165 | 0.27230 |
14 | 0.25395 | 0.93835 | 0.27230 |
15 | 0.50395 | 0.31165 | 0.52230 |
16 | 0.99605 | 0.18835 | 0.52230 |
Set of atoms in the unit cell related by symmetry with the atom O2:
Atom | x | y | z |
1 | 0.14428 | 0.43776 | 0.02860 |
2 | 0.85572 | 0.56224 | 0.02860 |
3 | 0.10572 | 0.68776 | 0.27860 |
4 | 0.39428 | 0.81224 | 0.27860 |
(0,1/2,1/2) + set click here to show and hide |
5 | 0.14428 | 0.93776 | 0.52860 |
6 | 0.85572 | 0.06224 | 0.52860 |
7 | 0.10572 | 0.18776 | 0.77860 |
8 | 0.39428 | 0.31224 | 0.77860 |
(1/2,0,1/2) + set click here to show and hide |
9 | 0.64428 | 0.43776 | 0.52860 |
10 | 0.35572 | 0.56224 | 0.52860 |
11 | 0.60572 | 0.68776 | 0.77860 |
12 | 0.89428 | 0.81224 | 0.77860 |
(1/2,1/2,0) + set click here to show and hide |
13 | 0.64428 | 0.93776 | 0.02860 |
14 | 0.35572 | 0.06224 | 0.02860 |
15 | 0.60572 | 0.18776 | 0.27860 |
16 | 0.89428 | 0.31224 | 0.27860 |
Set of atoms in the unit cell related by symmetry with the atom O3:
Atom | x | y | z |
1 | 0.16200 | 0.34608 | 0.45510 |
2 | 0.83800 | 0.65392 | 0.45510 |
3 | 0.08800 | 0.59608 | 0.70510 |
4 | 0.41200 | 0.90392 | 0.70510 |
(0,1/2,1/2) + set click here to show and hide |
5 | 0.16200 | 0.84608 | 0.95510 |
6 | 0.83800 | 0.15392 | 0.95510 |
7 | 0.08800 | 0.09608 | 0.20510 |
8 | 0.41200 | 0.40392 | 0.20510 |
(1/2,0,1/2) + set click here to show and hide |
9 | 0.66200 | 0.34608 | 0.95510 |
10 | 0.33800 | 0.65392 | 0.95510 |
11 | 0.58800 | 0.59608 | 0.20510 |
12 | 0.91200 | 0.90392 | 0.20510 |
(1/2,1/2,0) + set click here to show and hide |
13 | 0.66200 | 0.84608 | 0.45510 |
14 | 0.33800 | 0.15392 | 0.45510 |
15 | 0.58800 | 0.09608 | 0.70510 |
16 | 0.91200 | 0.40392 | 0.70510 |
Set of atoms in the unit cell related by symmetry with the atom O4:
Atom | x | y | z |
1 | 0.00000 | 0.00000 | 0.90070 |
2 | 0.25000 | 0.25000 | 0.15070 |
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3 | 0.00000 | 0.50000 | 0.40070 |
4 | 0.25000 | 0.75000 | 0.65070 |
(1/2,0,1/2) + set click here to show and hide |
5 | 0.50000 | 0.00000 | 0.40070 |
6 | 0.75000 | 0.25000 | 0.65070 |
(1/2,1/2,0) + set click here to show and hide |
7 | 0.50000 | 0.50000 | 0.90070 |
8 | 0.75000 | 0.75000 | 0.15070 |
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