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

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N	(x,y,z)	Seitz notation
1	x,y,z,+1	1
2	-x,-y,-z,+1	-1
1' + set click here to show and hide
3	x,y,z,-1	1'
4	-x,-y,-z,-1	-1'

Magnetic atoms:

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Mn1	Mn	0.00000	0.00000	0.00000	8	m_x,m_y,m_z	-1.79(6)	0.0	1.71(6)	2.92

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
Na1	Na	0.00000	0.25000	0.50000	8
O1	O	0.14880	0.00000	0.79860	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 Mn1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.00000	0.00000	m_x,m_y,m_z	-1.79000	0.00000	1.71000
(1/4,3/4,0) + set click here to show and hide
2	0.25000	0.75000	0.00000	m_x,m_y,m_z	-1.79000	0.00000	1.71000
(1/2,1/2,0) + set click here to show and hide
3	0.50000	0.50000	0.00000	m_x,m_y,m_z	-1.79000	0.00000	1.71000
(3/4,1/4,0) + set click here to show and hide
4	0.75000	0.25000	0.00000	m_x,m_y,m_z	-1.79000	0.00000	1.71000
(3/4,3/4,0)' + set click here to show and hide
5	0.75000	0.75000	0.00000	-m_x,-m_y,-m_z	1.79000	0.00000	-1.71000
(0,1/2,0)' + set click here to show and hide
6	0.00000	0.50000	0.00000	-m_x,-m_y,-m_z	1.79000	0.00000	-1.71000
(1/4,1/4,0)' + set click here to show and hide
7	0.25000	0.25000	0.00000	-m_x,-m_y,-m_z	1.79000	0.00000	-1.71000
(1/2,0,0)' + set click here to show and hide
8	0.50000	0.00000	0.00000	-m_x,-m_y,-m_z	1.79000	0.00000	-1.71000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom Na1:

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

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

Atom	x	y	z
1	0.14880	0.00000	0.79860
2	0.85120	0.00000	0.20140
(1/4,3/4,0) + set click here to show and hide
3	0.39880	0.75000	0.79860
4	0.10120	0.75000	0.20140
(1/2,1/2,0) + set click here to show and hide
5	0.64880	0.50000	0.79860
6	0.35120	0.50000	0.20140
(3/4,1/4,0) + set click here to show and hide
7	0.89880	0.25000	0.79860
8	0.60120	0.25000	0.20140
(3/4,3/4,0)' + set click here to show and hide
9	0.89880	0.75000	0.79860
10	0.60120	0.75000	0.20140
(0,1/2,0)' + set click here to show and hide
11	0.14880	0.50000	0.79860
12	0.85120	0.50000	0.20140
(1/4,1/4,0)' + set click here to show and hide
13	0.39880	0.25000	0.79860
14	0.10120	0.25000	0.20140
(1/2,0,0)' + set click here to show and hide
15	0.64880	0.00000	0.79860
16	0.35120	0.00000	0.20140

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Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Mn1	Mn	0.00000	0.00000	0.00000	8	m_x,m_y,m_z	-1.79(6)	0.0	1.71(6)	2.92

label	dim. small irrep	dim. full irrep	action	number of modes
mV1+	1	2	primary	3

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