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+3/4,z+3/4,-y,+1	{ 4^-₁₀₀ \| 3/4 3/4 0 }
3	x+3/4,-z,y+3/4,+1	{ 4⁺₁₀₀ \| 3/4 0 3/4 }
4	x,-y+3/4,-z+3/4,+1	{ 2₁₀₀ \| 0 3/4 3/4 }
5	-x+1/2,-y+1/2,-z,+1	{ -1 \| 1/2 1/2 0 }
6	-x+3/4,-z+3/4,y,+1	{ -4^-₁₀₀ \| 3/4 3/4 0 }
7	-x+3/4,z+1/2,-y+1/4,+1	{ -4⁺₁₀₀ \| 3/4 1/2 1/4 }
8	-x+1/2,y+1/4,z+3/4,+1	{ m₁₀₀ \| 1/2 1/4 3/4 }
9	-x+1/2,z+1/4,y+3/4,-1	{ 2'₀₁₁ \| 1/2 1/4 3/4 }
10	-x+1/2,-z+1/2,-y,-1	{ 2'_01-1 \| 1/2 1/2 0 }
11	-x+3/4,y+1/2,-z+1/4,-1	{ 2'₀₁₀ \| 3/4 1/2 1/4 }
12	-x+3/4,-y+3/4,z,-1	{ 2'₀₀₁ \| 3/4 3/4 0 }
13	x,-z+1/4,-y+1/4,-1	{ m'₀₁₁ \| 0 1/4 1/4 }
14	x,z+1/2,y+1/2,-1	{ m'_01-1 \| 0 1/2 1/2 }
15	x+3/4,-y,z+3/4,-1	{ m'₀₁₀ \| 3/4 0 3/4 }
16	x+3/4,y+3/4,-z,-1	{ m'₀₀₁ \| 3/4 3/4 0 }
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17	x,y+1/2,z+1/2,+1	{ 1 \| 0 1/2 1/2 }
18	x+3/4,z+1/4,-y+1/2,+1	{ 4^-₁₀₀ \| 3/4 1/4 1/2 }
19	x+3/4,-z+1/2,y+1/4,+1	{ 4⁺₁₀₀ \| 3/4 1/2 1/4 }
20	x,-y+1/4,-z+1/4,+1	{ 2₁₀₀ \| 0 1/4 1/4 }
21	-x+1/2,-y,-z+1/2,+1	{ -1 \| 1/2 0 1/2 }
22	-x+3/4,-z+1/4,y+1/2,+1	{ -4^-₁₀₀ \| 3/4 1/4 1/2 }
23	-x+3/4,z,-y+3/4,+1	{ -4⁺₁₀₀ \| 3/4 0 3/4 }
24	-x+1/2,y+3/4,z+1/4,+1	{ m₁₀₀ \| 1/2 3/4 1/4 }
25	-x+1/2,z+3/4,y+1/4,-1	{ 2'₀₁₁ \| 1/2 3/4 1/4 }
26	-x+1/2,-z,-y+1/2,-1	{ 2'_01-1 \| 1/2 0 1/2 }
27	-x+3/4,y,-z+3/4,-1	{ 2'₀₁₀ \| 3/4 0 3/4 }
28	-x+3/4,-y+1/4,z+1/2,-1	{ 2'₀₀₁ \| 3/4 1/4 1/2 }
29	x,-z+3/4,-y+3/4,-1	{ m'₀₁₁ \| 0 3/4 3/4 }
30	x,z,y,-1	{ m'_01-1 \| 0 }
31	x+3/4,-y+1/2,z+1/4,-1	{ m'₀₁₀ \| 3/4 1/2 1/4 }
32	x+3/4,y+1/4,-z+1/2,-1	{ m'₀₀₁ \| 3/4 1/4 1/2 }
(1/2,0,1/2) + set click here to show and hide
33	x+1/2,y,z+1/2,+1	{ 1 \| 1/2 0 1/2 }
34	x+1/4,z+3/4,-y+1/2,+1	{ 4^-₁₀₀ \| 1/4 3/4 1/2 }
35	x+1/4,-z,y+1/4,+1	{ 4⁺₁₀₀ \| 1/4 0 1/4 }
36	x+1/2,-y+3/4,-z+1/4,+1	{ 2₁₀₀ \| 1/2 3/4 1/4 }
37	-x,-y+1/2,-z+1/2,+1	{ -1 \| 0 1/2 1/2 }
38	-x+1/4,-z+3/4,y+1/2,+1	{ -4^-₁₀₀ \| 1/4 3/4 1/2 }
39	-x+1/4,z+1/2,-y+3/4,+1	{ -4⁺₁₀₀ \| 1/4 1/2 3/4 }
40	-x,y+1/4,z+1/4,+1	{ m₁₀₀ \| 0 1/4 1/4 }
41	-x,z+1/4,y+1/4,-1	{ 2'₀₁₁ \| 0 1/4 1/4 }
42	-x,-z+1/2,-y+1/2,-1	{ 2'_01-1 \| 0 1/2 1/2 }
43	-x+1/4,y+1/2,-z+3/4,-1	{ 2'₀₁₀ \| 1/4 1/2 3/4 }
44	-x+1/4,-y+3/4,z+1/2,-1	{ 2'₀₀₁ \| 1/4 3/4 1/2 }
45	x+1/2,-z+1/4,-y+3/4,-1	{ m'₀₁₁ \| 1/2 1/4 3/4 }
46	x+1/2,z+1/2,y,-1	{ m'_01-1 \| 1/2 1/2 0 }
47	x+1/4,-y,z+1/4,-1	{ m'₀₁₀ \| 1/4 0 1/4 }
48	x+1/4,y+3/4,-z+1/2,-1	{ m'₀₀₁ \| 1/4 3/4 1/2 }
(1/2,1/2,0) + set click here to show and hide
49	x+1/2,y+1/2,z,+1	{ 1 \| 1/2 1/2 0 }
50	x+1/4,z+1/4,-y,+1	{ 4^-₁₀₀ \| 1/4 1/4 0 }
51	x+1/4,-z+1/2,y+3/4,+1	{ 4⁺₁₀₀ \| 1/4 1/2 3/4 }
52	x+1/2,-y+1/4,-z+3/4,+1	{ 2₁₀₀ \| 1/2 1/4 3/4 }
53	-x,-y,-z,+1	{ -1 \| 0 }
54	-x+1/4,-z+1/4,y,+1	{ -4^-₁₀₀ \| 1/4 1/4 0 }
55	-x+1/4,z,-y+1/4,+1	{ -4⁺₁₀₀ \| 1/4 0 1/4 }
56	-x,y+3/4,z+3/4,+1	{ m₁₀₀ \| 0 3/4 3/4 }
57	-x,z+3/4,y+3/4,-1	{ 2'₀₁₁ \| 0 3/4 3/4 }
58	-x,-z,-y,-1	{ 2'_01-1 \| 0 }
59	-x+1/4,y,-z+1/4,-1	{ 2'₀₁₀ \| 1/4 0 1/4 }
60	-x+1/4,-y+1/4,z,-1	{ 2'₀₀₁ \| 1/4 1/4 0 }
61	x+1/2,-z+3/4,-y+1/4,-1	{ m'₀₁₁ \| 1/2 3/4 1/4 }
62	x+1/2,z,y+1/2,-1	{ m'_01-1 \| 1/2 0 1/2 }
63	x+1/4,-y+1/2,z+3/4,-1	{ m'₀₁₀ \| 1/4 1/2 3/4 }
64	x+1/4,y+1/4,-z,-1	{ m'₀₀₁ \| 1/4 1/4 0 }

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N	(x,y,z)	Seitz notation
1	x,y,z,+1	1
2	x,z,-y,+1	4^-₁₀₀
3	x,-z,y,+1	4⁺₁₀₀
4	x,-y,-z,+1	2₁₀₀
5	-x,-y,-z,+1	-1
6	-x,-z,y,+1	-4^-₁₀₀
7	-x,z,-y,+1	-4⁺₁₀₀
8	-x,y,z,+1	m₁₀₀
9	-x,z,y,-1	2'₀₁₁
10	-x,-z,-y,-1	2'_01-1
11	-x,y,-z,-1	2'₀₁₀
12	-x,-y,z,-1	2'₀₀₁
13	x,-z,-y,-1	m'₀₁₁
14	x,z,y,-1	m'_01-1
15	x,-y,z,-1	m'₀₁₀
16	x,y,-z,-1	m'₀₀₁

Magnetic atoms:

Label	Atom type	x	y	z	Occupancy	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Co1	Co	0.00000	0.00000	0.00000	0.5	16	m_x,m_z,m_z	2.57(11)	0.0	0.0	2.57
Co2	Co	0.37500	0.37500	0.37500	1.	8	m_x,0,0	-2.04(7)	0.0	0.0	2.04

Non-magnetic atoms:

Label	Atom type	x	y	z	Occupancy	Multiplicity
Sn1	Sn	0.00000	0.00000	0.00000	0.5	16
O1	O	0.246	0.246	0.246	1.	32

[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 Co1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.00000	0.00000	m_x,m_z,m_z	2.57000	0.00000	0.00000
2	0.75000	0.75000	0.00000	m_x,m_z,-m_z	2.57000	0.00000	0.00000
3	0.75000	0.00000	0.75000	m_x,-m_z,m_z	2.57000	0.00000	0.00000
4	0.00000	0.75000	0.75000	m_x,-m_z,-m_z	2.57000	0.00000	0.00000
(0,1/2,1/2) + set click here to show and hide
5	0.00000	0.50000	0.50000	m_x,m_z,m_z	2.57000	0.00000	0.00000
6	0.75000	0.25000	0.50000	m_x,m_z,-m_z	2.57000	0.00000	0.00000
7	0.75000	0.50000	0.25000	m_x,-m_z,m_z	2.57000	0.00000	0.00000
8	0.00000	0.25000	0.25000	m_x,-m_z,-m_z	2.57000	0.00000	0.00000
(1/2,0,1/2) + set click here to show and hide
9	0.50000	0.00000	0.50000	m_x,m_z,m_z	2.57000	0.00000	0.00000
10	0.25000	0.75000	0.50000	m_x,m_z,-m_z	2.57000	0.00000	0.00000
11	0.25000	0.00000	0.25000	m_x,-m_z,m_z	2.57000	0.00000	0.00000
12	0.50000	0.75000	0.25000	m_x,-m_z,-m_z	2.57000	0.00000	0.00000
(1/2,1/2,0) + set click here to show and hide
13	0.50000	0.50000	0.00000	m_x,m_z,m_z	2.57000	0.00000	0.00000
14	0.25000	0.25000	0.00000	m_x,m_z,-m_z	2.57000	0.00000	0.00000
15	0.25000	0.50000	0.75000	m_x,-m_z,m_z	2.57000	0.00000	0.00000
16	0.50000	0.25000	0.75000	m_x,-m_z,-m_z	2.57000	0.00000	0.00000

Set of atoms in the unit cell related by symmetry with the magnetic atom Co2:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.37500	0.37500	0.37500	m_x,0,0	-2.04000	0.00000	0.00000
2	0.12500	0.12500	0.62500	m_x,0,0	-2.04000	0.00000	0.00000
(0,1/2,1/2) + set click here to show and hide
3	0.37500	0.87500	0.87500	m_x,0,0	-2.04000	0.00000	0.00000
4	0.12500	0.62500	0.12500	m_x,0,0	-2.04000	0.00000	0.00000
(1/2,0,1/2) + set click here to show and hide
5	0.87500	0.37500	0.87500	m_x,0,0	-2.04000	0.00000	0.00000
6	0.62500	0.12500	0.12500	m_x,0,0	-2.04000	0.00000	0.00000
(1/2,1/2,0) + set click here to show and hide
7	0.87500	0.87500	0.37500	m_x,0,0	-2.04000	0.00000	0.00000
8	0.62500	0.62500	0.62500	m_x,0,0	-2.04000	0.00000	0.00000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom Sn1:

Atom	x	y	z
1	0.00000	0.00000	0.00000
2	0.75000	0.75000	0.00000
3	0.75000	0.00000	0.75000
4	0.00000	0.75000	0.75000
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5	0.00000	0.50000	0.50000
6	0.75000	0.25000	0.50000
7	0.75000	0.50000	0.25000
8	0.00000	0.25000	0.25000
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9	0.50000	0.00000	0.50000
10	0.25000	0.75000	0.50000
11	0.25000	0.00000	0.25000
12	0.50000	0.75000	0.25000
(1/2,1/2,0) + set click here to show and hide
13	0.50000	0.50000	0.00000
14	0.25000	0.25000	0.00000
15	0.25000	0.50000	0.75000
16	0.50000	0.25000	0.75000

Set of atoms in the unit cell related by symmetry with the atom O1:

Atom	x	y	z
1	0.24600	0.24600	0.24600
2	0.99600	0.99600	0.75400
3	0.99600	0.75400	0.99600
4	0.24600	0.50400	0.50400
5	0.25400	0.25400	0.75400
6	0.50400	0.50400	0.24600
7	0.50400	0.74600	0.00400
8	0.25400	0.49600	0.99600
(0,1/2,1/2) + set click here to show and hide
9	0.24600	0.74600	0.74600
10	0.99600	0.49600	0.25400
11	0.99600	0.25400	0.49600
12	0.24600	0.00400	0.00400
13	0.25400	0.75400	0.25400
14	0.50400	0.00400	0.74600
15	0.50400	0.24600	0.50400
16	0.25400	0.99600	0.49600
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17	0.74600	0.24600	0.74600
18	0.49600	0.99600	0.25400
19	0.49600	0.75400	0.49600
20	0.74600	0.50400	0.00400
21	0.75400	0.25400	0.25400
22	0.00400	0.50400	0.74600
23	0.00400	0.74600	0.50400
24	0.75400	0.49600	0.49600
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25	0.74600	0.74600	0.24600
26	0.49600	0.49600	0.75400
27	0.49600	0.25400	0.99600
28	0.74600	0.00400	0.50400
29	0.75400	0.75400	0.75400
30	0.00400	0.00400	0.24600
31	0.00400	0.24600	0.00400
32	0.75400	0.99600	0.99600

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Label	Atom type	x	y	z	Occupancy	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Co1	Co	0.00000	0.00000	0.00000	0.5	16	m_x,m_z,m_z	2.57(11)	0.0	0.0	2.57
Co2	Co	0.37500	0.37500	0.37500	1.	8	m_x,0,0	-2.04(7)	0.0	0.0	2.04

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

label	dim. full irrep	dim. small irrep	direction	action	number of modes
mGM4+	3	3	special	primary	3

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

SnCo₂O₄ (#0.886)

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

SnCo2O4 (#0.886)

SnCo₂O₄ (#0.886)