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	{ 2₀₁₀ \| 0 }
3	x,y,-z+1/2,+1	{ m₀₀₁ \| 0 0 1/2 }
4	-x,-2x+y,z+1/2,+1	{ m₁₁₀ \| 0 0 1/2 }
(1/2,0,1/2) + set click here to show and hide
5	x+1/2,y,z+1/2,+1	{ 1 \| 1/2 0 1/2 }
6	-x+1/2,-2x+y,-z+1/2,+1	{ 2₀₁₀ \| 1/2 0 1/2 }
7	x+1/2,y,-z,+1	{ m₀₀₁ \| 1/2 0 0 }
8	-x+1/2,-2x+y,z,+1	{ m₁₁₀ \| 1/2 0 0 }
(0,0,1/2)' + set click here to show and hide
9	x,y,z+1/2,-1	{ 1' \| 0 0 1/2 }
10	-x,-2x+y,-z+1/2,-1	{ 2'₀₁₀ \| 0 0 1/2 }
11	x,y,-z,-1	{ m'₀₀₁ \| 0 }
12	-x,-2x+y,z,-1	{ m'₁₁₀ \| 0 }
(1/2,0,0)' + set click here to show and hide
13	x+1/2,y,z,-1	{ 1' \| 1/2 0 0 }
14	-x+1/2,-2x+y,-z,-1	{ 2'₀₁₀ \| 1/2 0 0 }
15	x+1/2,y,-z+1/2,-1	{ m'₀₀₁ \| 1/2 0 1/2 }
16	-x+1/2,-2x+y,z+1/2,-1	{ m'₁₁₀ \| 1/2 0 1/2 }

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N	(x,y,z)	Seitz notation
1	x,y,z,+1	1
2	-x,-2x+y,-z,+1	2₀₁₀
3	x,y,-z,+1	m₀₀₁
4	-x,-2x+y,z,+1	m₁₁₀
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	m'₀₀₁
8	-x,-2x+y,z,-1	m'₁₁₀

Magnetic atoms:

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Tb1_1	Tb	0.27205	0.00000	0.25000	8	0,0,m_z	0.0	0.0	7.9(2)	7.90
Tb1_2	Tb	0.00000	0.54410	0.25000	4	0,0,m_z	0.0	0.0	1.2(3)	1.20

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
Al1_1	Al	0.11600	0.00000	0.00000	8
Al1_2	Al	0.00000	0.23200	0.00000	4
Ni1	Ni	0.00000	0.00000	0.25000	4
Ni2	Ni	0.16667	0.66667	0.00000	8

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_1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.27205	0.00000	0.25000	0,0,m_z	0.00000	0.00000	7.90000
2	0.72795	0.45590	0.75000	0,0,-m_z	0.00000	0.00000	-7.90000
(1/2,0,1/2) + set click here to show and hide
3	0.77205	0.00000	0.75000	0,0,m_z	0.00000	0.00000	7.90000
4	0.22795	0.45590	0.25000	0,0,-m_z	0.00000	0.00000	-7.90000
(0,0,1/2)' + set click here to show and hide
5	0.27205	0.00000	0.75000	0,0,-m_z	0.00000	0.00000	-7.90000
6	0.72795	0.45590	0.25000	0,0,m_z	0.00000	0.00000	7.90000
(1/2,0,0)' + set click here to show and hide
7	0.77205	0.00000	0.25000	0,0,-m_z	0.00000	0.00000	-7.90000
8	0.22795	0.45590	0.75000	0,0,m_z	0.00000	0.00000	7.90000

Set of atoms in the unit cell related by symmetry with the magnetic atom Tb1_2:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.54410	0.25000	0,0,m_z	0.00000	0.00000	1.20000
(1/2,0,1/2) + set click here to show and hide
2	0.50000	0.54410	0.75000	0,0,m_z	0.00000	0.00000	1.20000
(0,0,1/2)' + set click here to show and hide
3	0.00000	0.54410	0.75000	0,0,-m_z	0.00000	0.00000	-1.20000
(1/2,0,0)' + set click here to show and hide
4	0.50000	0.54410	0.25000	0,0,-m_z	0.00000	0.00000	-1.20000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom Al1_1:

Atom	x	y	z
1	0.11600	0.00000	0.00000
2	0.88400	0.76800	0.00000
(1/2,0,1/2) + set click here to show and hide
3	0.61600	0.00000	0.50000
4	0.38400	0.76800	0.50000
(0,0,1/2)' + set click here to show and hide
5	0.11600	0.00000	0.50000
6	0.88400	0.76800	0.50000
(1/2,0,0)' + set click here to show and hide
7	0.61600	0.00000	0.00000
8	0.38400	0.76800	0.00000

Set of atoms in the unit cell related by symmetry with the atom Al1_2:

Atom	x	y	z
1	0.00000	0.23200	0.00000
(1/2,0,1/2) + set click here to show and hide
2	0.50000	0.23200	0.50000
(0,0,1/2)' + set click here to show and hide
3	0.00000	0.23200	0.50000
(1/2,0,0)' + set click here to show and hide
4	0.50000	0.23200	0.00000

Set of atoms in the unit cell related by symmetry with the atom Ni1:

Atom	x	y	z
1	0.00000	0.00000	0.25000
(1/2,0,1/2) + set click here to show and hide
2	0.50000	0.00000	0.75000
(0,0,1/2)' + set click here to show and hide
3	0.00000	0.00000	0.75000
(1/2,0,0)' + set click here to show and hide
4	0.50000	0.00000	0.25000

Set of atoms in the unit cell related by symmetry with the atom Ni2:

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

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Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Tb1_1	Tb	0.27205	0.00000	0.25000	8	0,0,m_z	0.0	0.0	7.9(2)	7.90
Tb1_2	Tb	0.00000	0.54410	0.25000	4	0,0,m_z	0.0	0.0	1.2(3)	1.20

label	dim. small irrep	dim. full irrep	action	number of modes
mL2	1	3	primary	2

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