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	{ 2₀₁₀ \| 0 }
3	-x,-y,-z,+1	{ -1 \| 0 }
4	x,-y,z,+1	{ m₀₁₀ \| 0 }
(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	{ 2₀₁₀ \| 1/2 1/2 0 }
7	-x+1/2,-y+1/2,-z,+1	{ -1 \| 1/2 1/2 0 }
8	x+1/2,-y+1/2,z,+1	{ m₀₁₀ \| 1/2 1/2 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,y,-z+1/2,-1	{ 2'₀₁₀ \| 0 0 1/2 }
11	-x,-y,-z+1/2,-1	{ -1' \| 0 0 1/2 }
12	x,-y,z+1/2,-1	{ m'₀₁₀ \| 0 0 1/2 }
(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,-1	{ 2'₀₁₀ \| 1/2 1/2 1/2 }
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+1/2,-1	{ m'₀₁₀ \| 1/2 1/2 1/2 }

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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	-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

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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	0.33770	0.00000	0.9	8	0,m_y,0	0.0	2.618(4)	0.0	2.62

Non-magnetic atoms:

Label	Atom type	x	y	z	Occupancy	Multiplicity
Li1	Li	0.00000	0.16630	0.25000	1.	8
Li2	Li	0.00000	0.50000	0.25000	1.	4
Li3	Li	0.00000	0.33770	0.00000	0.1	8
Sb1	Sb	0.00000	0.00000	0.00000	1.	4
O1	O	0.76200	0.00000	0.11320	1.	8
O2	O	0.23600	0.15698	0.11665	0.975	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 Co1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.33770	0.00000	0,m_y,0	0.00000	2.61800	0.00000
2	0.00000	0.66230	0.00000	0,m_y,0	0.00000	2.61800	0.00000
(1/2,1/2,0) + set click here to show and hide
3	0.50000	0.83770	0.00000	0,m_y,0	0.00000	2.61800	0.00000
4	0.50000	0.16230	0.00000	0,m_y,0	0.00000	2.61800	0.00000
(0,0,1/2)' + set click here to show and hide
5	0.00000	0.33770	0.50000	0,-m_y,0	0.00000	-2.61800	0.00000
6	0.00000	0.66230	0.50000	0,-m_y,0	0.00000	-2.61800	0.00000
(1/2,1/2,1/2)' + set click here to show and hide
7	0.50000	0.83770	0.50000	0,-m_y,0	0.00000	-2.61800	0.00000
8	0.50000	0.16230	0.50000	0,-m_y,0	0.00000	-2.61800	0.00000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom Li1:

Atom	x	y	z
1	0.00000	0.16630	0.25000
2	0.00000	0.83370	0.75000
(1/2,1/2,0) + set click here to show and hide
3	0.50000	0.66630	0.25000
4	0.50000	0.33370	0.75000
(0,0,1/2)' + set click here to show and hide
5	0.00000	0.16630	0.75000
6	0.00000	0.83370	0.25000
(1/2,1/2,1/2)' + set click here to show and hide
7	0.50000	0.66630	0.75000
8	0.50000	0.33370	0.25000

Set of atoms in the unit cell related by symmetry with the atom Li2:

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

Set of atoms in the unit cell related by symmetry with the atom Li3:

Atom	x	y	z
1	0.00000	0.33770	0.00000
2	0.00000	0.66230	0.00000
(1/2,1/2,0) + set click here to show and hide
3	0.50000	0.83770	0.00000
4	0.50000	0.16230	0.00000
(0,0,1/2)' + set click here to show and hide
5	0.00000	0.33770	0.50000
6	0.00000	0.66230	0.50000
(1/2,1/2,1/2)' + set click here to show and hide
7	0.50000	0.83770	0.50000
8	0.50000	0.16230	0.50000

Set of atoms in the unit cell related by symmetry with the atom Sb1:

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

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

Atom	x	y	z
1	0.76200	0.00000	0.11320
2	0.23800	0.00000	0.88680
(1/2,1/2,0) + set click here to show and hide
3	0.26200	0.50000	0.11320
4	0.73800	0.50000	0.88680
(0,0,1/2)' + set click here to show and hide
5	0.76200	0.00000	0.61320
6	0.23800	0.00000	0.38680
(1/2,1/2,1/2)' + set click here to show and hide
7	0.26200	0.50000	0.61320
8	0.73800	0.50000	0.38680

Set of atoms in the unit cell related by symmetry with the atom O2:

Atom	x	y	z
1	0.23600	0.15698	0.11665
2	0.76400	0.15698	0.88335
3	0.76400	0.84302	0.88335
4	0.23600	0.84302	0.11665
(1/2,1/2,0) + set click here to show and hide
5	0.73600	0.65698	0.11665
6	0.26400	0.65698	0.88335
7	0.26400	0.34302	0.88335
8	0.73600	0.34302	0.11665
(0,0,1/2)' + set click here to show and hide
9	0.23600	0.15698	0.61665
10	0.76400	0.15698	0.38335
11	0.76400	0.84302	0.38335
12	0.23600	0.84302	0.61665
(1/2,1/2,1/2)' + set click here to show and hide
13	0.73600	0.65698	0.61665
14	0.26400	0.65698	0.38335
15	0.26400	0.34302	0.38335
16	0.73600	0.34302	0.61665

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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	0.33770	0.00000	0.9	8	0,m_y,0	0.0	2.618(4)	0.0	2.62

label	dim. small irrep	dim. full irrep	action	number of modes
mA1+	1	1	primary	1

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