MAGNDATA - Collection of Magnetic Structures

Symmetry operations of the magnetic space group in the setting used:

N	(x,y,z)	Seitz notation
1	x,y,z,+1	{ 1 \| 0 }
2	-x,-2x+y,-z+1/2,+1	{ 2₀₁₀ \| 0 0 1/2 }
3	-x,-y,-z+1/2,+1	{ -1 \| 0 0 1/2 }
4	x,2x-y,z,+1	{ m₀₁₀ \| 0 }
(1/6,2/3,5/6) + set click here to show and hide
5	x+1/6,y+2/3,z+5/6,+1	{ 1 \| 1/6 2/3 5/6 }
6	-x+1/6,-2x+y+2/3,-z+1/3,+1	{ 2₀₁₀ \| 1/6 2/3 1/3 }
7	-x+1/6,-y+2/3,-z+1/3,+1	{ -1 \| 1/6 2/3 1/3 }
8	x+1/6,2x-y+2/3,z+5/6,+1	{ m₀₁₀ \| 1/6 2/3 5/6 }
(1/3,1/3,2/3) + set click here to show and hide
9	x+1/3,y+1/3,z+2/3,+1	{ 1 \| 1/3 1/3 2/3 }
10	-x+1/3,-2x+y+1/3,-z+1/6,+1	{ 2₀₁₀ \| 1/3 1/3 1/6 }
11	-x+1/3,-y+1/3,-z+1/6,+1	{ -1 \| 1/3 1/3 1/6 }
12	x+1/3,2x-y+1/3,z+2/3,+1	{ m₀₁₀ \| 1/3 1/3 2/3 }
(1/2,0,1/2) + set click here to show and hide
13	x+1/2,y,z+1/2,+1	{ 1 \| 1/2 0 1/2 }
14	-x+1/2,-2x+y,-z,+1	{ 2₀₁₀ \| 1/2 0 0 }
15	-x+1/2,-y,-z,+1	{ -1 \| 1/2 0 0 }
16	x+1/2,2x-y,z+1/2,+1	{ m₀₁₀ \| 1/2 0 1/2 }
(2/3,2/3,1/3) + set click here to show and hide
17	x+2/3,y+2/3,z+1/3,+1	{ 1 \| 2/3 2/3 1/3 }
18	-x+2/3,-2x+y+2/3,-z+5/6,+1	{ 2₀₁₀ \| 2/3 2/3 5/6 }
19	-x+2/3,-y+2/3,-z+5/6,+1	{ -1 \| 2/3 2/3 5/6 }
20	x+2/3,2x-y+2/3,z+1/3,+1	{ m₀₁₀ \| 2/3 2/3 1/3 }
(5/6,1/3,1/6) + set click here to show and hide
21	x+5/6,y+1/3,z+1/6,+1	{ 1 \| 5/6 1/3 1/6 }
22	-x+5/6,-2x+y+1/3,-z+2/3,+1	{ 2₀₁₀ \| 5/6 1/3 2/3 }
23	-x+5/6,-y+1/3,-z+2/3,+1	{ -1 \| 5/6 1/3 2/3 }
24	x+5/6,2x-y+1/3,z+1/6,+1	{ m₀₁₀ \| 5/6 1/3 1/6 }
(1/3,1/3,1/6)' + set click here to show and hide
25	x+1/3,y+1/3,z+1/6,-1	{ 1' \| 1/3 1/3 1/6 }
26	-x+1/3,-2x+y+1/3,-z+2/3,-1	{ 2'₀₁₀ \| 1/3 1/3 2/3 }
27	-x+1/3,-y+1/3,-z+2/3,-1	{ -1' \| 1/3 1/3 2/3 }
28	x+1/3,2x-y+1/3,z+1/6,-1	{ m'₀₁₀ \| 1/3 1/3 1/6 }
(1/2,0,0)' + set click here to show and hide
29	x+1/2,y,z,-1	{ 1' \| 1/2 0 0 }
30	-x+1/2,-2x+y,-z+1/2,-1	{ 2'₀₁₀ \| 1/2 0 1/2 }
31	-x+1/2,-y,-z+1/2,-1	{ -1' \| 1/2 0 1/2 }
32	x+1/2,2x-y,z,-1	{ m'₀₁₀ \| 1/2 0 0 }
(2/3,2/3,5/6)' + set click here to show and hide
33	x+2/3,y+2/3,z+5/6,-1	{ 1' \| 2/3 2/3 5/6 }
34	-x+2/3,-2x+y+2/3,-z+1/3,-1	{ 2'₀₁₀ \| 2/3 2/3 1/3 }
35	-x+2/3,-y+2/3,-z+1/3,-1	{ -1' \| 2/3 2/3 1/3 }
36	x+2/3,2x-y+2/3,z+5/6,-1	{ m'₀₁₀ \| 2/3 2/3 5/6 }
(5/6,1/3,2/3)' + set click here to show and hide
37	x+5/6,y+1/3,z+2/3,-1	{ 1' \| 5/6 1/3 2/3 }
38	-x+5/6,-2x+y+1/3,-z+1/6,-1	{ 2'₀₁₀ \| 5/6 1/3 1/6 }
39	-x+5/6,-y+1/3,-z+1/6,-1	{ -1' \| 5/6 1/3 1/6 }
40	x+5/6,2x-y+1/3,z+2/3,-1	{ m'₀₁₀ \| 5/6 1/3 2/3 }
(0,0,1/2)' + set click here to show and hide
41	x,y,z+1/2,-1	{ 1' \| 0 0 1/2 }
42	-x,-2x+y,-z,-1	{ 2'₀₁₀ \| 0 }
43	-x,-y,-z,-1	{ -1' \| 0 }
44	x,2x-y,z+1/2,-1	{ m'₀₁₀ \| 0 0 1/2 }
(1/6,2/3,1/3)' + set click here to show and hide
45	x+1/6,y+2/3,z+1/3,-1	{ 1' \| 1/6 2/3 1/3 }
46	-x+1/6,-2x+y+2/3,-z+5/6,-1	{ 2'₀₁₀ \| 1/6 2/3 5/6 }
47	-x+1/6,-y+2/3,-z+5/6,-1	{ -1' \| 1/6 2/3 5/6 }
48	x+1/6,2x-y+2/3,z+1/3,-1	{ m'₀₁₀ \| 1/6 2/3 1/3 }

[Hide]

N	(x,y,z)	Seitz notation
1	x,y,z,+1	1
2	-x,-2x+y,-z,+1	2₀₁₀
3	-x,-y,-z,+1	-1
4	x,2x-y,z,+1	m₀₁₀
1' + set click here to show and hide
5	x,y,z,-1	1'
6	-x,-2x+y,-z,-1	2'₀₁₀
7	-x,-y,-z,-1	-1'
8	x,2x-y,z,-1	m'₀₁₀

Magnetic atoms:

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Er1	Er	0.00000	0.00000	0.25000	12	0,m_y,0	0.0	3.06(1)	0.0	3.06

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
K1	K	0.00000	0.00000	0.00000	12
Se1	Se	0.00000	0.00000	0.11770	24

[Show all atoms in unit cell and their moment relations]

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 Er1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.00000	0.25000	0,m_y,0	0.00000	3.06000	0.00000
(1/6,2/3,5/6) + set click here to show and hide
2	0.16667	0.66667	0.08333	0,m_y,0	0.00000	3.06000	0.00000
(1/3,1/3,2/3) + set click here to show and hide
3	0.33333	0.33333	0.91667	0,m_y,0	0.00000	3.06000	0.00000
(1/2,0,1/2) + set click here to show and hide
4	0.50000	0.00000	0.75000	0,m_y,0	0.00000	3.06000	0.00000
(2/3,2/3,1/3) + set click here to show and hide
5	0.66667	0.66667	0.58333	0,m_y,0	0.00000	3.06000	0.00000
(5/6,1/3,1/6) + set click here to show and hide
6	0.83333	0.33333	0.41667	0,m_y,0	0.00000	3.06000	0.00000
(1/3,1/3,1/6)' + set click here to show and hide
7	0.33333	0.33333	0.41667	0,-m_y,0	0.00000	-3.06000	0.00000
(1/2,0,0)' + set click here to show and hide
8	0.50000	0.00000	0.25000	0,-m_y,0	0.00000	-3.06000	0.00000
(2/3,2/3,5/6)' + set click here to show and hide
9	0.66667	0.66667	0.08333	0,-m_y,0	0.00000	-3.06000	0.00000
(5/6,1/3,2/3)' + set click here to show and hide
10	0.83333	0.33333	0.91667	0,-m_y,0	0.00000	-3.06000	0.00000
(0,0,1/2)' + set click here to show and hide
11	0.00000	0.00000	0.75000	0,-m_y,0	0.00000	-3.06000	0.00000
(1/6,2/3,1/3)' + set click here to show and hide
12	0.16667	0.66667	0.58333	0,-m_y,0	0.00000	-3.06000	0.00000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom K1:

Atom	x	y	z
1	0.00000	0.00000	0.00000
(1/6,2/3,5/6) + set click here to show and hide
2	0.16667	0.66667	0.83333
(1/3,1/3,2/3) + set click here to show and hide
3	0.33333	0.33333	0.66667
(1/2,0,1/2) + set click here to show and hide
4	0.50000	0.00000	0.50000
(2/3,2/3,1/3) + set click here to show and hide
5	0.66667	0.66667	0.33333
(5/6,1/3,1/6) + set click here to show and hide
6	0.83333	0.33333	0.16667
(1/3,1/3,1/6)' + set click here to show and hide
7	0.33333	0.33333	0.16667
(1/2,0,0)' + set click here to show and hide
8	0.50000	0.00000	0.00000
(2/3,2/3,5/6)' + set click here to show and hide
9	0.66667	0.66667	0.83333
(5/6,1/3,2/3)' + set click here to show and hide
10	0.83333	0.33333	0.66667
(0,0,1/2)' + set click here to show and hide
11	0.00000	0.00000	0.50000
(1/6,2/3,1/3)' + set click here to show and hide
12	0.16667	0.66667	0.33333

Set of atoms in the unit cell related by symmetry with the atom Se1:

Atom	x	y	z
1	0.00000	0.00000	0.11770
2	0.00000	0.00000	0.38230
(1/6,2/3,5/6) + set click here to show and hide
3	0.16667	0.66667	0.95103
4	0.16667	0.66667	0.21563
(1/3,1/3,2/3) + set click here to show and hide
5	0.33333	0.33333	0.78437
6	0.33333	0.33333	0.04897
(1/2,0,1/2) + set click here to show and hide
7	0.50000	0.00000	0.61770
8	0.50000	0.00000	0.88230
(2/3,2/3,1/3) + set click here to show and hide
9	0.66667	0.66667	0.45103
10	0.66667	0.66667	0.71563
(5/6,1/3,1/6) + set click here to show and hide
11	0.83333	0.33333	0.28437
12	0.83333	0.33333	0.54897
(1/3,1/3,1/6)' + set click here to show and hide
13	0.33333	0.33333	0.28437
14	0.33333	0.33333	0.54897
(1/2,0,0)' + set click here to show and hide
15	0.50000	0.00000	0.11770
16	0.50000	0.00000	0.38230
(2/3,2/3,5/6)' + set click here to show and hide
17	0.66667	0.66667	0.95103
18	0.66667	0.66667	0.21563
(5/6,1/3,2/3)' + set click here to show and hide
19	0.83333	0.33333	0.78437
20	0.83333	0.33333	0.04897
(0,0,1/2)' + set click here to show and hide
21	0.00000	0.00000	0.61770
22	0.00000	0.00000	0.88230
(1/6,2/3,1/3)' + set click here to show and hide
23	0.16667	0.66667	0.45103
24	0.16667	0.66667	0.71563

[Hide]

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Er1	Er	0.00000	0.00000	0.25000	12	0,m_y,0	0.0	3.06(1)	0.0	3.06

[Show all magnetic atoms in unit cell and their moment relations]

label	dim. small irrep	dim. full irrep	action	number of modes
mL2-	1	3	primary	1

MAGNDATA: A Collection of magnetic structures with portable cif-type files

KErSe₂ (#1.578)

MAGNDATA: A Collection of magnetic structures with portable cif-type files

KErSe2 (#1.578)

KErSe₂ (#1.578)