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,x-y,z,+1	{ 3⁺₀₀₁ \| 0 }
3	-x+y,-x,z,+1	{ 3^-₀₀₁ \| 0 }
4	y,x,-z+1/2,+1	{ 2₁₁₀ \| 0 0 1/2 }
5	x-y,-y,-z+1/2,+1	{ 2₁₀₀ \| 0 0 1/2 }
6	-x,-x+y,-z+1/2,+1	{ 2₀₁₀ \| 0 0 1/2 }
7	-x,-y,-z,+1	{ -1 \| 0 }
8	y,-x+y,-z,+1	{ -3⁺₀₀₁ \| 0 }
9	x-y,x,-z,+1	{ -3^-₀₀₁ \| 0 }
10	-y,-x,z+1/2,+1	{ m₁₁₀ \| 0 0 1/2 }
11	-x+y,y,z+1/2,+1	{ m₁₀₀ \| 0 0 1/2 }
12	x,x-y,z+1/2,+1	{ m₀₁₀ \| 0 0 1/2 }
(2/3,1/3,1/3) + set click here to show and hide
13	x+2/3,y+1/3,z+1/3,+1	{ 1 \| 2/3 1/3 1/3 }
14	-y+2/3,x-y+1/3,z+1/3,+1	{ 3⁺₀₀₁ \| 2/3 1/3 1/3 }
15	-x+y+2/3,-x+1/3,z+1/3,+1	{ 3^-₀₀₁ \| 2/3 1/3 1/3 }
16	y+2/3,x+1/3,-z+5/6,+1	{ 2₁₁₀ \| 2/3 1/3 5/6 }
17	x-y+2/3,-y+1/3,-z+5/6,+1	{ 2₁₀₀ \| 2/3 1/3 5/6 }
18	-x+2/3,-x+y+1/3,-z+5/6,+1	{ 2₀₁₀ \| 2/3 1/3 5/6 }
19	-x+2/3,-y+1/3,-z+1/3,+1	{ -1 \| 2/3 1/3 1/3 }
20	y+2/3,-x+y+1/3,-z+1/3,+1	{ -3⁺₀₀₁ \| 2/3 1/3 1/3 }
21	x-y+2/3,x+1/3,-z+1/3,+1	{ -3^-₀₀₁ \| 2/3 1/3 1/3 }
22	-y+2/3,-x+1/3,z+5/6,+1	{ m₁₁₀ \| 2/3 1/3 5/6 }
23	-x+y+2/3,y+1/3,z+5/6,+1	{ m₁₀₀ \| 2/3 1/3 5/6 }
24	x+2/3,x-y+1/3,z+5/6,+1	{ m₀₁₀ \| 2/3 1/3 5/6 }
(1/3,2/3,2/3) + set click here to show and hide
25	x+1/3,y+2/3,z+2/3,+1	{ 1 \| 1/3 2/3 2/3 }
26	-y+1/3,x-y+2/3,z+2/3,+1	{ 3⁺₀₀₁ \| 1/3 2/3 2/3 }
27	-x+y+1/3,-x+2/3,z+2/3,+1	{ 3^-₀₀₁ \| 1/3 2/3 2/3 }
28	y+1/3,x+2/3,-z+1/6,+1	{ 2₁₁₀ \| 1/3 2/3 1/6 }
29	x-y+1/3,-y+2/3,-z+1/6,+1	{ 2₁₀₀ \| 1/3 2/3 1/6 }
30	-x+1/3,-x+y+2/3,-z+1/6,+1	{ 2₀₁₀ \| 1/3 2/3 1/6 }
31	-x+1/3,-y+2/3,-z+2/3,+1	{ -1 \| 1/3 2/3 2/3 }
32	y+1/3,-x+y+2/3,-z+2/3,+1	{ -3⁺₀₀₁ \| 1/3 2/3 2/3 }
33	x-y+1/3,x+2/3,-z+2/3,+1	{ -3^-₀₀₁ \| 1/3 2/3 2/3 }
34	-y+1/3,-x+2/3,z+1/6,+1	{ m₁₁₀ \| 1/3 2/3 1/6 }
35	-x+y+1/3,y+2/3,z+1/6,+1	{ m₁₀₀ \| 1/3 2/3 1/6 }
36	x+1/3,x-y+2/3,z+1/6,+1	{ m₀₁₀ \| 1/3 2/3 1/6 }

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

N	(x,y,z)	Seitz notation
1	x,y,z,+1	1
2	-y,x-y,z,+1	3⁺₀₀₁
3	-x+y,-x,z,+1	3^-₀₀₁
4	y,x,-z,+1	2₁₁₀
5	x-y,-y,-z,+1	2₁₀₀
6	-x,-x+y,-z,+1	2₀₁₀
7	-x,-y,-z,+1	-1
8	y,-x+y,-z,+1	-3⁺₀₀₁
9	x-y,x,-z,+1	-3^-₀₀₁
10	-y,-x,z,+1	m₁₁₀
11	-x+y,y,z,+1	m₁₀₀
12	x,x-y,z,+1	m₀₁₀

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Magnetic atoms:

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Tb1	Tb	0	0	0.08387	12	0,0,m_z	0.0	0.0	4.89	4.89

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
Pt1	Pt	0.21218	0	0.25	18
Pt2	Pt	0	0	0	6
Pt3	Pt	0	0	0.162636(10)	12
Pt4	Pt	0.34429	0.01413	0.03887	36
Al1	Al	0.3485	0.0017	0.19174	36

[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 Tb1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.00000	0.08387	0,0,m_z	0.00000	0.00000	4.89000
2	0.00000	0.00000	0.41613	0,0,-m_z	0.00000	0.00000	-4.89000
3	0.00000	0.00000	0.91613	0,0,m_z	0.00000	0.00000	4.89000
4	0.00000	0.00000	0.58387	0,0,-m_z	0.00000	0.00000	-4.89000
(2/3,1/3,1/3) + set click here to show and hide
5	0.66667	0.33333	0.41720	0,0,m_z	0.00000	0.00000	4.89000
6	0.66667	0.33333	0.74946	0,0,-m_z	0.00000	0.00000	-4.89000
7	0.66667	0.33333	0.24946	0,0,m_z	0.00000	0.00000	4.89000
8	0.66667	0.33333	0.91720	0,0,-m_z	0.00000	0.00000	-4.89000
(1/3,2/3,2/3) + set click here to show and hide
9	0.33333	0.66667	0.75054	0,0,m_z	0.00000	0.00000	4.89000
10	0.33333	0.66667	0.08280	0,0,-m_z	0.00000	0.00000	-4.89000
11	0.33333	0.66667	0.58280	0,0,m_z	0.00000	0.00000	4.89000
12	0.33333	0.66667	0.25054	0,0,-m_z	0.00000	0.00000	-4.89000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom Pt1:

Atom	x	y	z
1	0.21218	0.00000	0.25000
2	0.00000	0.21218	0.25000
3	0.78782	0.78782	0.25000
4	0.78782	0.00000	0.75000
5	0.00000	0.78782	0.75000
6	0.21218	0.21218	0.75000
(2/3,1/3,1/3) + set click here to show and hide
7	0.87885	0.33333	0.58333
8	0.66667	0.54551	0.58333
9	0.45449	0.12115	0.58333
10	0.45449	0.33333	0.08333
11	0.66667	0.12115	0.08333
12	0.87885	0.54551	0.08333
(1/3,2/3,2/3) + set click here to show and hide
13	0.54551	0.66667	0.91667
14	0.33333	0.87885	0.91667
15	0.12115	0.45449	0.91667
16	0.12115	0.66667	0.41667
17	0.33333	0.45449	0.41667
18	0.54551	0.87885	0.41667

Set of atoms in the unit cell related by symmetry with the atom Pt2:

Atom	x	y	z
1	0.00000	0.00000	0.00000
2	0.00000	0.00000	0.50000
(2/3,1/3,1/3) + set click here to show and hide
3	0.66667	0.33333	0.33333
4	0.66667	0.33333	0.83333
(1/3,2/3,2/3) + set click here to show and hide
5	0.33333	0.66667	0.66667
6	0.33333	0.66667	0.16667

Set of atoms in the unit cell related by symmetry with the atom Pt3:

Atom	x	y	z
1	0.00000	0.00000	0.16264
2	0.00000	0.00000	0.33736
3	0.00000	0.00000	0.83736
4	0.00000	0.00000	0.66264
(2/3,1/3,1/3) + set click here to show and hide
5	0.66667	0.33333	0.49597
6	0.66667	0.33333	0.67070
7	0.66667	0.33333	0.17070
8	0.66667	0.33333	0.99597
(1/3,2/3,2/3) + set click here to show and hide
9	0.33333	0.66667	0.82930
10	0.33333	0.66667	0.00403
11	0.33333	0.66667	0.50403
12	0.33333	0.66667	0.32930

Set of atoms in the unit cell related by symmetry with the atom Pt4:

Atom	x	y	z
1	0.34429	0.01413	0.03887
2	0.98587	0.33016	0.03887
3	0.66984	0.65571	0.03887
4	0.01413	0.34429	0.46113
5	0.33016	0.98587	0.46113
6	0.65571	0.66984	0.46113
7	0.65571	0.98587	0.96113
8	0.01413	0.66984	0.96113
9	0.33016	0.34429	0.96113
10	0.98587	0.65571	0.53887
11	0.66984	0.01413	0.53887
12	0.34429	0.33016	0.53887
(2/3,1/3,1/3) + set click here to show and hide
13	0.01096	0.34746	0.37220
14	0.65254	0.66349	0.37220
15	0.33651	0.98904	0.37220
16	0.68080	0.67762	0.79446
17	0.99683	0.31920	0.79446
18	0.32238	0.00317	0.79446
19	0.32238	0.31920	0.29446
20	0.68080	0.00317	0.29446
21	0.99683	0.67762	0.29446
22	0.65254	0.98904	0.87220
23	0.33651	0.34746	0.87220
24	0.01096	0.66349	0.87220
(1/3,2/3,2/3) + set click here to show and hide
25	0.67762	0.68080	0.70554
26	0.31920	0.99683	0.70554
27	0.00317	0.32238	0.70554
28	0.34746	0.01096	0.12780
29	0.66349	0.65254	0.12780
30	0.98904	0.33651	0.12780
31	0.98904	0.65254	0.62780
32	0.34746	0.33651	0.62780
33	0.66349	0.01096	0.62780
34	0.31920	0.32238	0.20554
35	0.00317	0.68080	0.20554
36	0.67762	0.99683	0.20554

Set of atoms in the unit cell related by symmetry with the atom Al1:

Atom	x	y	z
1	0.34850	0.00170	0.19174
2	0.99830	0.34680	0.19174
3	0.65320	0.65150	0.19174
4	0.00170	0.34850	0.30826
5	0.34680	0.99830	0.30826
6	0.65150	0.65320	0.30826
7	0.65150	0.99830	0.80826
8	0.00170	0.65320	0.80826
9	0.34680	0.34850	0.80826
10	0.99830	0.65150	0.69174
11	0.65320	0.00170	0.69174
12	0.34850	0.34680	0.69174
(2/3,1/3,1/3) + set click here to show and hide
13	0.01517	0.33503	0.52507
14	0.66497	0.68013	0.52507
15	0.31987	0.98483	0.52507
16	0.66837	0.68183	0.64159
17	0.01347	0.33163	0.64159
18	0.31817	0.98653	0.64159
19	0.31817	0.33163	0.14159
20	0.66837	0.98653	0.14159
21	0.01347	0.68183	0.14159
22	0.66497	0.98483	0.02507
23	0.31987	0.33503	0.02507
24	0.01517	0.68013	0.02507
(1/3,2/3,2/3) + set click here to show and hide
25	0.68183	0.66837	0.85841
26	0.33163	0.01347	0.85841
27	0.98653	0.31817	0.85841
28	0.33503	0.01517	0.97493
29	0.68013	0.66497	0.97493
30	0.98483	0.31987	0.97493
31	0.98483	0.66497	0.47493
32	0.33503	0.31987	0.47493
33	0.68013	0.01517	0.47493
34	0.33163	0.31817	0.35841
35	0.98653	0.66837	0.35841
36	0.68183	0.01347	0.35841

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Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Tb1	Tb	0	0	0.08387	12	0,0,m_z	0.0	0.0	4.89	4.89

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

label	dim. small irrep	dim. full irrep	action	number of modes
mGM1+	1	1	primary	1

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

TbPt₆Al₃ (#0.1176)

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

TbPt6Al3 (#0.1176)

TbPt₆Al₃ (#0.1176)