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	y+1/3,x+1/6,-z+1/3,+1	{ 2₁₁₀ \| 1/3 1/6 1/3 }
3	-x,-y,-z,+1	{ -1 \| 0 }
4	-y+1/3,-x+1/6,z+1/3,+1	{ m₁₁₀ \| 1/3 1/6 1/3 }
(1/6,5/6,2/3) + set click here to show and hide
5	x+1/6,y+5/6,z+2/3,+1	{ 1 \| 1/6 5/6 2/3 }
6	y+1/2,x,-z,+1	{ 2₁₁₀ \| 1/2 0 0 }
7	-x+1/6,-y+5/6,-z+2/3,+1	{ -1 \| 1/6 5/6 2/3 }
8	-y+1/2,-x,z,+1	{ m₁₁₀ \| 1/2 0 0 }
(1/3,2/3,1/3) + set click here to show and hide
9	x+1/3,y+2/3,z+1/3,+1	{ 1 \| 1/3 2/3 1/3 }
10	y+2/3,x+5/6,-z+2/3,+1	{ 2₁₁₀ \| 2/3 5/6 2/3 }
11	-x+1/3,-y+2/3,-z+1/3,+1	{ -1 \| 1/3 2/3 1/3 }
12	-y+2/3,-x+5/6,z+2/3,+1	{ m₁₁₀ \| 2/3 5/6 2/3 }
(1/2,1/2,0) + set click here to show and hide
13	x+1/2,y+1/2,z,+1	{ 1 \| 1/2 1/2 0 }
14	y+5/6,x+2/3,-z+1/3,+1	{ 2₁₁₀ \| 5/6 2/3 1/3 }
15	-x+1/2,-y+1/2,-z,+1	{ -1 \| 1/2 1/2 0 }
16	-y+5/6,-x+2/3,z+1/3,+1	{ m₁₁₀ \| 5/6 2/3 1/3 }
(2/3,1/3,2/3) + set click here to show and hide
17	x+2/3,y+1/3,z+2/3,+1	{ 1 \| 2/3 1/3 2/3 }
18	y,x+1/2,-z,+1	{ 2₁₁₀ \| 0 1/2 0 }
19	-x+2/3,-y+1/3,-z+2/3,+1	{ -1 \| 2/3 1/3 2/3 }
20	-y,-x+1/2,z,+1	{ m₁₁₀ \| 0 1/2 0 }
(5/6,1/6,1/3) + set click here to show and hide
21	x+5/6,y+1/6,z+1/3,+1	{ 1 \| 5/6 1/6 1/3 }
22	y+1/6,x+1/3,-z+2/3,+1	{ 2₁₁₀ \| 1/6 1/3 2/3 }
23	-x+5/6,-y+1/6,-z+1/3,+1	{ -1 \| 5/6 1/6 1/3 }
24	-y+1/6,-x+1/3,z+2/3,+1	{ m₁₁₀ \| 1/6 1/3 2/3 }
(1/3,1/6,1/3)' + set click here to show and hide
25	x+1/3,y+1/6,z+1/3,-1	{ 1' \| 1/3 1/6 1/3 }
26	y+2/3,x+1/3,-z+2/3,-1	{ 2'₁₁₀ \| 2/3 1/3 2/3 }
27	-x+1/3,-y+1/6,-z+1/3,-1	{ -1' \| 1/3 1/6 1/3 }
28	-y+2/3,-x+1/3,z+2/3,-1	{ m'₁₁₀ \| 2/3 1/3 2/3 }
(1/2,0,0)' + set click here to show and hide
29	x+1/2,y,z,-1	{ 1' \| 1/2 0 0 }
30	y+5/6,x+1/6,-z+1/3,-1	{ 2'₁₁₀ \| 5/6 1/6 1/3 }
31	-x+1/2,-y,-z,-1	{ -1' \| 1/2 0 0 }
32	-y+5/6,-x+1/6,z+1/3,-1	{ m'₁₁₀ \| 5/6 1/6 1/3 }
(2/3,5/6,2/3)' + set click here to show and hide
33	x+2/3,y+5/6,z+2/3,-1	{ 1' \| 2/3 5/6 2/3 }
34	y,x,-z,-1	{ 2'₁₁₀ \| 0 }
35	-x+2/3,-y+5/6,-z+2/3,-1	{ -1' \| 2/3 5/6 2/3 }
36	-y,-x,z,-1	{ m'₁₁₀ \| 0 }
(5/6,2/3,1/3)' + set click here to show and hide
37	x+5/6,y+2/3,z+1/3,-1	{ 1' \| 5/6 2/3 1/3 }
38	y+1/6,x+5/6,-z+2/3,-1	{ 2'₁₁₀ \| 1/6 5/6 2/3 }
39	-x+5/6,-y+2/3,-z+1/3,-1	{ -1' \| 5/6 2/3 1/3 }
40	-y+1/6,-x+5/6,z+2/3,-1	{ m'₁₁₀ \| 1/6 5/6 2/3 }
(0,1/2,0)' + set click here to show and hide
41	x,y+1/2,z,-1	{ 1' \| 0 1/2 0 }
42	y+1/3,x+2/3,-z+1/3,-1	{ 2'₁₁₀ \| 1/3 2/3 1/3 }
43	-x,-y+1/2,-z,-1	{ -1' \| 0 1/2 0 }
44	-y+1/3,-x+2/3,z+1/3,-1	{ m'₁₁₀ \| 1/3 2/3 1/3 }
(1/6,1/3,2/3)' + set click here to show and hide
45	x+1/6,y+1/3,z+2/3,-1	{ 1' \| 1/6 1/3 2/3 }
46	y+1/2,x+1/2,-z,-1	{ 2'₁₁₀ \| 1/2 1/2 0 }
47	-x+1/6,-y+1/3,-z+2/3,-1	{ -1' \| 1/6 1/3 2/3 }
48	-y+1/2,-x+1/2,z,-1	{ m'₁₁₀ \| 1/2 1/2 0 }

[Hide]

N	(x,y,z)	Seitz notation
1	x,y,z,+1	1
2	y,x,-z,+1	2₁₁₀
3	-x,-y,-z,+1	-1
4	-y,-x,z,+1	m₁₁₀
1' + set click here to show and hide
5	x,y,z,-1	1'
6	y,x,-z,-1	2'₁₁₀
7	-x,-y,-z,-1	-1'
8	-y,-x,z,-1	m'₁₁₀

Magnetic atoms:

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Mn1	Mn	0.00000	0.00000	0.00000	12	m_x,-m_x,m_z	1.96	-1.96	-2.95	4.50

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
Ba1	Ba	0.00000	0.00000	0.26400	24
Te1	Te	0.00000	0.00000	0.50000	12
O1_1	O	0.07877	0.92123	0.57607	24
O1_2	O	0.07877	0.15753	0.57607	48

[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 Mn1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.00000	0.00000	m_x,-m_x,m_z	1.96000	-1.96000	-2.95000
(1/6,5/6,2/3) + set click here to show and hide
2	0.16667	0.83333	0.66667	m_x,-m_x,m_z	1.96000	-1.96000	-2.95000
(1/3,2/3,1/3) + set click here to show and hide
3	0.33333	0.66667	0.33333	m_x,-m_x,m_z	1.96000	-1.96000	-2.95000
(1/2,1/2,0) + set click here to show and hide
4	0.50000	0.50000	0.00000	m_x,-m_x,m_z	1.96000	-1.96000	-2.95000
(2/3,1/3,2/3) + set click here to show and hide
5	0.66667	0.33333	0.66667	m_x,-m_x,m_z	1.96000	-1.96000	-2.95000
(5/6,1/6,1/3) + set click here to show and hide
6	0.83333	0.16667	0.33333	m_x,-m_x,m_z	1.96000	-1.96000	-2.95000
(1/3,1/6,1/3)' + set click here to show and hide
7	0.33333	0.16667	0.33333	-m_x,m_x,-m_z	-1.96000	1.96000	2.95000
(1/2,0,0)' + set click here to show and hide
8	0.50000	0.00000	0.00000	-m_x,m_x,-m_z	-1.96000	1.96000	2.95000
(2/3,5/6,2/3)' + set click here to show and hide
9	0.66667	0.83333	0.66667	-m_x,m_x,-m_z	-1.96000	1.96000	2.95000
(5/6,2/3,1/3)' + set click here to show and hide
10	0.83333	0.66667	0.33333	-m_x,m_x,-m_z	-1.96000	1.96000	2.95000
(0,1/2,0)' + set click here to show and hide
11	0.00000	0.50000	0.00000	-m_x,m_x,-m_z	-1.96000	1.96000	2.95000
(1/6,1/3,2/3)' + set click here to show and hide
12	0.16667	0.33333	0.66667	-m_x,m_x,-m_z	-1.96000	1.96000	2.95000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom Ba1:

Atom	x	y	z
1	0.00000	0.00000	0.26400
2	0.33333	0.16667	0.06933
(1/6,5/6,2/3) + set click here to show and hide
3	0.16667	0.83333	0.93067
4	0.50000	0.00000	0.73600
(1/3,2/3,1/3) + set click here to show and hide
5	0.33333	0.66667	0.59733
6	0.66667	0.83333	0.40267
(1/2,1/2,0) + set click here to show and hide
7	0.50000	0.50000	0.26400
8	0.83333	0.66667	0.06933
(2/3,1/3,2/3) + set click here to show and hide
9	0.66667	0.33333	0.93067
10	0.00000	0.50000	0.73600
(5/6,1/6,1/3) + set click here to show and hide
11	0.83333	0.16667	0.59733
12	0.16667	0.33333	0.40267
(1/3,1/6,1/3)' + set click here to show and hide
13	0.33333	0.16667	0.59733
14	0.66667	0.33333	0.40267
(1/2,0,0)' + set click here to show and hide
15	0.50000	0.00000	0.26400
16	0.83333	0.16667	0.06933
(2/3,5/6,2/3)' + set click here to show and hide
17	0.66667	0.83333	0.93067
18	0.00000	0.00000	0.73600
(5/6,2/3,1/3)' + set click here to show and hide
19	0.83333	0.66667	0.59733
20	0.16667	0.83333	0.40267
(0,1/2,0)' + set click here to show and hide
21	0.00000	0.50000	0.26400
22	0.33333	0.66667	0.06933
(1/6,1/3,2/3)' + set click here to show and hide
23	0.16667	0.33333	0.93067
24	0.50000	0.50000	0.73600

Set of atoms in the unit cell related by symmetry with the atom Te1:

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

Set of atoms in the unit cell related by symmetry with the atom O1_1:

Atom	x	y	z
1	0.07877	0.92123	0.57607
2	0.25456	0.24544	0.75726
(1/6,5/6,2/3) + set click here to show and hide
3	0.24544	0.75456	0.24274
4	0.42123	0.07877	0.42393
(1/3,2/3,1/3) + set click here to show and hide
5	0.41210	0.58790	0.90940
6	0.58790	0.91210	0.09060
(1/2,1/2,0) + set click here to show and hide
7	0.57877	0.42123	0.57607
8	0.75456	0.74544	0.75726
(2/3,1/3,2/3) + set click here to show and hide
9	0.74544	0.25456	0.24274
10	0.92123	0.57877	0.42393
(5/6,1/6,1/3) + set click here to show and hide
11	0.91210	0.08790	0.90940
12	0.08790	0.41210	0.09060
(1/3,1/6,1/3)' + set click here to show and hide
13	0.41210	0.08790	0.90940
14	0.58790	0.41210	0.09060
(1/2,0,0)' + set click here to show and hide
15	0.57877	0.92123	0.57607
16	0.75456	0.24544	0.75726
(2/3,5/6,2/3)' + set click here to show and hide
17	0.74544	0.75456	0.24274
18	0.92123	0.07877	0.42393
(5/6,2/3,1/3)' + set click here to show and hide
19	0.91210	0.58790	0.90940
20	0.08790	0.91210	0.09060
(0,1/2,0)' + set click here to show and hide
21	0.07877	0.42123	0.57607
22	0.25456	0.74544	0.75726
(1/6,1/3,2/3)' + set click here to show and hide
23	0.24544	0.25456	0.24274
24	0.42123	0.57877	0.42393

Set of atoms in the unit cell related by symmetry with the atom O1_2:

Atom	x	y	z
1	0.07877	0.15753	0.57607
2	0.49086	0.24544	0.75726
3	0.92123	0.84247	0.42393
4	0.17580	0.08790	0.90940
(1/6,5/6,2/3) + set click here to show and hide
5	0.24544	0.99086	0.24274
6	0.65753	0.07877	0.42393
7	0.08790	0.67580	0.09060
8	0.34247	0.92123	0.57607
(1/3,2/3,1/3) + set click here to show and hide
9	0.41210	0.82420	0.90940
10	0.82420	0.91210	0.09060
11	0.25456	0.50914	0.75726
12	0.50914	0.75456	0.24274
(1/2,1/2,0) + set click here to show and hide
13	0.57877	0.65753	0.57607
14	0.99086	0.74544	0.75726
15	0.42123	0.34247	0.42393
16	0.67580	0.58790	0.90940
(2/3,1/3,2/3) + set click here to show and hide
17	0.74544	0.49086	0.24274
18	0.15753	0.57877	0.42393
19	0.58790	0.17580	0.09060
20	0.84247	0.42123	0.57607
(5/6,1/6,1/3) + set click here to show and hide
21	0.91210	0.32420	0.90940
22	0.32420	0.41210	0.09060
23	0.75456	0.00914	0.75726
24	0.00914	0.25456	0.24274
(1/3,1/6,1/3)' + set click here to show and hide
25	0.41210	0.32420	0.90940
26	0.82420	0.41210	0.09060
27	0.25456	0.00914	0.75726
28	0.50914	0.25456	0.24274
(1/2,0,0)' + set click here to show and hide
29	0.57877	0.15753	0.57607
30	0.99086	0.24544	0.75726
31	0.42123	0.84247	0.42393
32	0.67580	0.08790	0.90940
(2/3,5/6,2/3)' + set click here to show and hide
33	0.74544	0.99086	0.24274
34	0.15753	0.07877	0.42393
35	0.58790	0.67580	0.09060
36	0.84247	0.92123	0.57607
(5/6,2/3,1/3)' + set click here to show and hide
37	0.91210	0.82420	0.90940
38	0.32420	0.91210	0.09060
39	0.75456	0.50914	0.75726
40	0.00914	0.75456	0.24274
(0,1/2,0)' + set click here to show and hide
41	0.07877	0.65753	0.57607
42	0.49086	0.74544	0.75726
43	0.92123	0.34247	0.42393
44	0.17580	0.58790	0.90940
(1/6,1/3,2/3)' + set click here to show and hide
45	0.24544	0.49086	0.24274
46	0.65753	0.57877	0.42393
47	0.08790	0.17580	0.09060
48	0.34247	0.42123	0.57607

[Hide]

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Mn1	Mn	0.00000	0.00000	0.00000	12	m_x,-m_x,m_z	1.96	-1.96	-2.95	4.50

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

label	dim. small irrep	dim. full irrep	action	number of modes
mF2+	1	3	primary	2

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

Ba₂MnTeO₆ (#1.538)

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

Ba2MnTeO6 (#1.538)

Ba₂MnTeO₆ (#1.538)