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 | 0.18005 | 0.25000 | 0.00000 | mx,my,mz | 0.00000 | 0.00000 | -1.77000 |
2 | 0.06995 | 0.50000 | 0.50000 | -mx,-my,mz | 0.00000 | 0.00000 | -1.77000 |
3 | 0.81995 | 0.75000 | 0.00000 | mx,my,mz | 0.00000 | 0.00000 | -1.77000 |
4 | 0.43005 | 0.00000 | 0.50000 | -mx,-my,mz | 0.00000 | 0.00000 | -1.77000 |
(3/4,3/4,0) + set click here to show and hide |
5 | 0.93005 | 0.00000 | 0.00000 | mx,my,mz | 0.00000 | 0.00000 | -1.77000 |
6 | 0.81995 | 0.25000 | 0.50000 | -mx,-my,mz | 0.00000 | 0.00000 | -1.77000 |
7 | 0.56995 | 0.50000 | 0.00000 | mx,my,mz | 0.00000 | 0.00000 | -1.77000 |
8 | 0.18005 | 0.75000 | 0.50000 | -mx,-my,mz | 0.00000 | 0.00000 | -1.77000 |
(1/2,1/2,0) + set click here to show and hide |
9 | 0.68005 | 0.75000 | 0.00000 | mx,my,mz | 0.00000 | 0.00000 | -1.77000 |
10 | 0.56995 | 0.00000 | 0.50000 | -mx,-my,mz | 0.00000 | 0.00000 | -1.77000 |
11 | 0.31995 | 0.25000 | 0.00000 | mx,my,mz | 0.00000 | 0.00000 | -1.77000 |
12 | 0.93005 | 0.50000 | 0.50000 | -mx,-my,mz | 0.00000 | 0.00000 | -1.77000 |
(1/4,1/4,0) + set click here to show and hide |
13 | 0.43005 | 0.50000 | 0.00000 | mx,my,mz | 0.00000 | 0.00000 | -1.77000 |
14 | 0.31995 | 0.75000 | 0.50000 | -mx,-my,mz | 0.00000 | 0.00000 | -1.77000 |
15 | 0.06995 | 0.00000 | 0.00000 | mx,my,mz | 0.00000 | 0.00000 | -1.77000 |
16 | 0.68005 | 0.25000 | 0.50000 | -mx,-my,mz | 0.00000 | 0.00000 | -1.77000 |
(3/4,1/4,0)' + set click here to show and hide |
17 | 0.93005 | 0.50000 | 0.00000 | -mx,-my,-mz | 0.00000 | 0.00000 | 1.77000 |
18 | 0.81995 | 0.75000 | 0.50000 | mx,my,-mz | 0.00000 | 0.00000 | 1.77000 |
19 | 0.56995 | 0.00000 | 0.00000 | -mx,-my,-mz | 0.00000 | 0.00000 | 1.77000 |
20 | 0.18005 | 0.25000 | 0.50000 | mx,my,-mz | 0.00000 | 0.00000 | 1.77000 |
(1/4,3/4,0)' + set click here to show and hide |
21 | 0.43005 | 0.00000 | 0.00000 | -mx,-my,-mz | 0.00000 | 0.00000 | 1.77000 |
22 | 0.31995 | 0.25000 | 0.50000 | mx,my,-mz | 0.00000 | 0.00000 | 1.77000 |
23 | 0.06995 | 0.50000 | 0.00000 | -mx,-my,-mz | 0.00000 | 0.00000 | 1.77000 |
24 | 0.68005 | 0.75000 | 0.50000 | mx,my,-mz | 0.00000 | 0.00000 | 1.77000 |
(1/2,0,0)' + set click here to show and hide |
25 | 0.68005 | 0.25000 | 0.00000 | -mx,-my,-mz | 0.00000 | 0.00000 | 1.77000 |
26 | 0.56995 | 0.50000 | 0.50000 | mx,my,-mz | 0.00000 | 0.00000 | 1.77000 |
27 | 0.31995 | 0.75000 | 0.00000 | -mx,-my,-mz | 0.00000 | 0.00000 | 1.77000 |
28 | 0.93005 | 0.00000 | 0.50000 | mx,my,-mz | 0.00000 | 0.00000 | 1.77000 |
(0,1/2,0)' + set click here to show and hide |
29 | 0.18005 | 0.75000 | 0.00000 | -mx,-my,-mz | 0.00000 | 0.00000 | 1.77000 |
30 | 0.06995 | 0.00000 | 0.50000 | mx,my,-mz | 0.00000 | 0.00000 | 1.77000 |
31 | 0.81995 | 0.25000 | 0.00000 | -mx,-my,-mz | 0.00000 | 0.00000 | 1.77000 |
32 | 0.43005 | 0.50000 | 0.50000 | mx,my,-mz | 0.00000 | 0.00000 | 1.77000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom Cs1:
Atom | x | y | z |
1 | 0.25000 | 0.08090 | 0.25000 |
2 | 0.00000 | 0.66910 | 0.75000 |
(3/4,3/4,0) + set click here to show and hide |
3 | 0.00000 | 0.83090 | 0.25000 |
4 | 0.75000 | 0.41910 | 0.75000 |
(1/2,1/2,0) + set click here to show and hide |
5 | 0.75000 | 0.58090 | 0.25000 |
6 | 0.50000 | 0.16910 | 0.75000 |
(1/4,1/4,0) + set click here to show and hide |
7 | 0.50000 | 0.33090 | 0.25000 |
8 | 0.25000 | 0.91910 | 0.75000 |
(3/4,1/4,0)' + set click here to show and hide |
9 | 0.00000 | 0.33090 | 0.25000 |
10 | 0.75000 | 0.91910 | 0.75000 |
(1/4,3/4,0)' + set click here to show and hide |
11 | 0.50000 | 0.83090 | 0.25000 |
12 | 0.25000 | 0.41910 | 0.75000 |
(1/2,0,0)' + set click here to show and hide |
13 | 0.75000 | 0.08090 | 0.25000 |
14 | 0.50000 | 0.66910 | 0.75000 |
(0,1/2,0)' + set click here to show and hide |
15 | 0.25000 | 0.58090 | 0.25000 |
16 | 0.00000 | 0.16910 | 0.75000 |
Set of atoms in the unit cell related by symmetry with the atom Se1:
Atom | x | y | z |
1 | 0.00000 | 0.06115 | 0.25000 |
2 | 0.25000 | 0.68885 | 0.75000 |
(3/4,3/4,0) + set click here to show and hide |
3 | 0.75000 | 0.81115 | 0.25000 |
4 | 0.00000 | 0.43885 | 0.75000 |
(1/2,1/2,0) + set click here to show and hide |
5 | 0.50000 | 0.56115 | 0.25000 |
6 | 0.75000 | 0.18885 | 0.75000 |
(1/4,1/4,0) + set click here to show and hide |
7 | 0.25000 | 0.31115 | 0.25000 |
8 | 0.50000 | 0.93885 | 0.75000 |
(3/4,1/4,0)' + set click here to show and hide |
9 | 0.75000 | 0.31115 | 0.25000 |
10 | 0.00000 | 0.93885 | 0.75000 |
(1/4,3/4,0)' + set click here to show and hide |
11 | 0.25000 | 0.81115 | 0.25000 |
12 | 0.50000 | 0.43885 | 0.75000 |
(1/2,0,0)' + set click here to show and hide |
13 | 0.50000 | 0.06115 | 0.25000 |
14 | 0.75000 | 0.68885 | 0.75000 |
(0,1/2,0)' + set click here to show and hide |
15 | 0.00000 | 0.56115 | 0.25000 |
16 | 0.25000 | 0.18885 | 0.75000 |
Set of atoms in the unit cell related by symmetry with the atom Se2_1:
Atom | x | y | z |
1 | 0.11360 | 0.19410 | 0.25000 |
2 | 0.13640 | 0.55590 | 0.75000 |
(3/4,3/4,0) + set click here to show and hide |
3 | 0.86360 | 0.94410 | 0.25000 |
4 | 0.88640 | 0.30590 | 0.75000 |
(1/2,1/2,0) + set click here to show and hide |
5 | 0.61360 | 0.69410 | 0.25000 |
6 | 0.63640 | 0.05590 | 0.75000 |
(1/4,1/4,0) + set click here to show and hide |
7 | 0.36360 | 0.44410 | 0.25000 |
8 | 0.38640 | 0.80590 | 0.75000 |
(3/4,1/4,0)' + set click here to show and hide |
9 | 0.86360 | 0.44410 | 0.25000 |
10 | 0.88640 | 0.80590 | 0.75000 |
(1/4,3/4,0)' + set click here to show and hide |
11 | 0.36360 | 0.94410 | 0.25000 |
12 | 0.38640 | 0.30590 | 0.75000 |
(1/2,0,0)' + set click here to show and hide |
13 | 0.61360 | 0.19410 | 0.25000 |
14 | 0.63640 | 0.55590 | 0.75000 |
(0,1/2,0)' + set click here to show and hide |
15 | 0.11360 | 0.69410 | 0.25000 |
16 | 0.13640 | 0.05590 | 0.75000 |
Set of atoms in the unit cell related by symmetry with the atom Se2_2:
Atom | x | y | z |
1 | 0.88640 | 0.19410 | 0.25000 |
2 | 0.36360 | 0.55590 | 0.75000 |
(3/4,3/4,0) + set click here to show and hide |
3 | 0.63640 | 0.94410 | 0.25000 |
4 | 0.11360 | 0.30590 | 0.75000 |
(1/2,1/2,0) + set click here to show and hide |
5 | 0.38640 | 0.69410 | 0.25000 |
6 | 0.86360 | 0.05590 | 0.75000 |
(1/4,1/4,0) + set click here to show and hide |
7 | 0.13640 | 0.44410 | 0.25000 |
8 | 0.61360 | 0.80590 | 0.75000 |
(3/4,1/4,0)' + set click here to show and hide |
9 | 0.63640 | 0.44410 | 0.25000 |
10 | 0.11360 | 0.80590 | 0.75000 |
(1/4,3/4,0)' + set click here to show and hide |
11 | 0.13640 | 0.94410 | 0.25000 |
12 | 0.61360 | 0.30590 | 0.75000 |
(1/2,0,0)' + set click here to show and hide |
13 | 0.38640 | 0.19410 | 0.25000 |
14 | 0.86360 | 0.55590 | 0.75000 |
(0,1/2,0)' + set click here to show and hide |
15 | 0.88640 | 0.69410 | 0.25000 |
16 | 0.36360 | 0.05590 | 0.75000 |
[Hide]