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,y,-z+1/2,+1	{ 2₀₁₀ \| 0 0 1/2 }
3	-x,-y,-z,+1	{ -1 \| 0 }
4	x,-y,z+1/2,+1	{ m₀₁₀ \| 0 0 1/2 }
(1/2,1/2,0) + set click here to show and hide
5	x+1/2,y+1/2,z,+1	{ 1 \| 1/2 1/2 0 }
6	-x+1/2,y+1/2,-z+1/2,+1	{ 2₀₁₀ \| 1/2 1/2 1/2 }
7	-x+1/2,-y+1/2,-z,+1	{ -1 \| 1/2 1/2 0 }
8	x+1/2,-y+1/2,z+1/2,+1	{ m₀₁₀ \| 1/2 1/2 1/2 }
(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,y,-z,-1	{ 2'₀₁₀ \| 0 }
11	-x,-y,-z+1/2,-1	{ -1' \| 0 0 1/2 }
12	x,-y,z,-1	{ m'₀₁₀ \| 0 }
(1/2,1/2,1/2)' + set click here to show and hide
13	x+1/2,y+1/2,z+1/2,-1	{ 1' \| 1/2 1/2 1/2 }
14	-x+1/2,y+1/2,-z,-1	{ 2'₀₁₀ \| 1/2 1/2 0 }
15	-x+1/2,-y+1/2,-z+1/2,-1	{ -1' \| 1/2 1/2 1/2 }
16	x+1/2,-y+1/2,z,-1	{ m'₀₁₀ \| 1/2 1/2 0 }

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N	(x,y,z)	Seitz notation
1	x,y,z,+1	1
2	-x,y,-z,+1	2₀₁₀
3	-x,-y,-z,+1	-1
4	x,-y,z,+1	m₀₁₀
1' + set click here to show and hide
5	x,y,z,-1	1'
6	-x,y,-z,-1	2'₀₁₀
7	-x,-y,-z,-1	-1'
8	x,-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\|
Ni1_1	Ni	0.00000	0.00000	0.00000	4	m_x,0,m_z	0.31	0.0	0.65	0.66
Ni1_2	Ni	0.50000	0.166667	0.00000	8	m_x,0,m_z	-0.155	0.0	-0.325	0.33

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
Ag1_1	Ag	0.217(2)	0.00000	0.32055(10)	8
Ag1_2	Ag	0.717	0.166667	0.32055	16
O1_1	O	0.378(2)	0.00000	0.06385(10)	8
O1_2	O	0.878	0.166667	0.06385	16

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 Ni1_1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.00000	0.00000	m_x,0,m_z	0.31000	0.00000	0.65000
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2	0.50000	0.50000	0.00000	m_x,0,m_z	0.31000	0.00000	0.65000
(0,0,1/2)' + set click here to show and hide
3	0.00000	0.00000	0.50000	-m_x,0,-m_z	-0.31000	0.00000	-0.65000
(1/2,1/2,1/2)' + set click here to show and hide
4	0.50000	0.50000	0.50000	-m_x,0,-m_z	-0.31000	0.00000	-0.65000

Set of atoms in the unit cell related by symmetry with the magnetic atom Ni1_2:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.50000	0.16667	0.00000	m_x,0,m_z	-0.15500	0.00000	-0.32500
2	0.50000	0.83333	0.00000	m_x,0,m_z	-0.15500	0.00000	-0.32500
(1/2,1/2,0) + set click here to show and hide
3	0.00000	0.66667	0.00000	m_x,0,m_z	-0.15500	0.00000	-0.32500
4	0.00000	0.33333	0.00000	m_x,0,m_z	-0.15500	0.00000	-0.32500
(0,0,1/2)' + set click here to show and hide
5	0.50000	0.16667	0.50000	-m_x,0,-m_z	0.15500	0.00000	0.32500
6	0.50000	0.83333	0.50000	-m_x,0,-m_z	0.15500	0.00000	0.32500
(1/2,1/2,1/2)' + set click here to show and hide
7	0.00000	0.66667	0.50000	-m_x,0,-m_z	0.15500	0.00000	0.32500
8	0.00000	0.33333	0.50000	-m_x,0,-m_z	0.15500	0.00000	0.32500

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom Ag1_1:

Atom	x	y	z
1	0.21700	0.00000	0.32055
2	0.78300	0.00000	0.17945
(1/2,1/2,0) + set click here to show and hide
3	0.71700	0.50000	0.32055
4	0.28300	0.50000	0.17945
(0,0,1/2)' + set click here to show and hide
5	0.21700	0.00000	0.82055
6	0.78300	0.00000	0.67945
(1/2,1/2,1/2)' + set click here to show and hide
7	0.71700	0.50000	0.82055
8	0.28300	0.50000	0.67945

Set of atoms in the unit cell related by symmetry with the atom Ag1_2:

Atom	x	y	z
1	0.71700	0.16667	0.32055
2	0.28300	0.16667	0.17945
3	0.28300	0.83333	0.67945
4	0.71700	0.83333	0.82055
(1/2,1/2,0) + set click here to show and hide
5	0.21700	0.66667	0.32055
6	0.78300	0.66667	0.17945
7	0.78300	0.33333	0.67945
8	0.21700	0.33333	0.82055
(0,0,1/2)' + set click here to show and hide
9	0.71700	0.16667	0.82055
10	0.28300	0.16667	0.67945
11	0.28300	0.83333	0.17945
12	0.71700	0.83333	0.32055
(1/2,1/2,1/2)' + set click here to show and hide
13	0.21700	0.66667	0.82055
14	0.78300	0.66667	0.67945
15	0.78300	0.33333	0.17945
16	0.21700	0.33333	0.32055

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

Atom	x	y	z
1	0.37800	0.00000	0.06385
2	0.62200	0.00000	0.43615
(1/2,1/2,0) + set click here to show and hide
3	0.87800	0.50000	0.06385
4	0.12200	0.50000	0.43615
(0,0,1/2)' + set click here to show and hide
5	0.37800	0.00000	0.56385
6	0.62200	0.00000	0.93615
(1/2,1/2,1/2)' + set click here to show and hide
7	0.87800	0.50000	0.56385
8	0.12200	0.50000	0.93615

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

Atom	x	y	z
1	0.87800	0.16667	0.06385
2	0.12200	0.16667	0.43615
3	0.12200	0.83333	0.93615
4	0.87800	0.83333	0.56385
(1/2,1/2,0) + set click here to show and hide
5	0.37800	0.66667	0.06385
6	0.62200	0.66667	0.43615
7	0.62200	0.33333	0.93615
8	0.37800	0.33333	0.56385
(0,0,1/2)' + set click here to show and hide
9	0.87800	0.16667	0.56385
10	0.12200	0.16667	0.93615
11	0.12200	0.83333	0.43615
12	0.87800	0.83333	0.06385
(1/2,1/2,1/2)' + set click here to show and hide
13	0.37800	0.66667	0.56385
14	0.62200	0.66667	0.93615
15	0.62200	0.33333	0.43615
16	0.37800	0.33333	0.06385

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Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Ni1_1	Ni	0.00000	0.00000	0.00000	4	m_x,0,m_z	0.31	0.0	0.65	0.66
Ni1_2	Ni	0.50000	0.166667	0.00000	8	m_x,0,m_z	-0.155	0.0	-0.325	0.33

label	dim. small irrep	dim. full irrep	action
mU2	1	2	primary

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