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	{ -1 \| 0 0 1/2 }
(0,1/2,1/2) + set click here to show and hide
3	x,y+1/2,z+1/2,+1	{ 1 \| 0 1/2 1/2 }
4	-x,-y+1/2,-z,+1	{ -1 \| 0 1/2 0 }
(0,0,1/2)' + set click here to show and hide
5	x,y,z+1/2,-1	{ 1' \| 0 0 1/2 }
6	-x,-y,-z,-1	{ -1' \| 0 }
(0,1/2,0)' + set click here to show and hide
7	x,y+1/2,z,-1	{ 1' \| 0 1/2 0 }
8	-x,-y+1/2,-z+1/2,-1	{ -1' \| 0 1/2 1/2 }

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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\|
Fe1_1	Fe	0.50000	0.00000	0.25000	4	m_x,m_y,m_z	-3.63(6)	0.39(5)	1.24(9)	3.86
Fe1_2	Fe	0.00000	0.25000	0.00000	4	m_x,m_y,m_z	-3.63	0.39	1.24	3.86

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
Sr1_1	Sr	0.99760	0.49440	0.37550	8
Sr1_2	Sr	0.50240	0.74440	0.87450	8
W1_1	W	0.50000	0.00000	0.00000	4
W1_2	W	0.00000	0.25000	0.25000	4
O1_1	O	0.28000	0.13050	0.01025	8
O1_2	O	0.22000	0.38050	0.23975	8
O2_1	O	0.24100	0.38900	0.01545	8
O2_2	O	0.25900	0.63900	0.23455	8
O3_1	O	0.04950	0.25350	0.36950	8
O3_2	O	0.45050	0.50350	0.88050	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 Fe1_1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.50000	0.00000	0.25000	m_x,m_y,m_z	-3.63000	0.39000	1.24000
(0,1/2,1/2) + set click here to show and hide
2	0.50000	0.50000	0.75000	m_x,m_y,m_z	-3.63000	0.39000	1.24000
(0,0,1/2)' + set click here to show and hide
3	0.50000	0.00000	0.75000	-m_x,-m_y,-m_z	3.63000	-0.39000	-1.24000
(0,1/2,0)' + set click here to show and hide
4	0.50000	0.50000	0.25000	-m_x,-m_y,-m_z	3.63000	-0.39000	-1.24000

Set of atoms in the unit cell related by symmetry with the magnetic atom Fe1_2:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.25000	0.00000	m_x,m_y,m_z	-3.63000	0.39000	1.24000
(0,1/2,1/2) + set click here to show and hide
2	0.00000	0.75000	0.50000	m_x,m_y,m_z	-3.63000	0.39000	1.24000
(0,0,1/2)' + set click here to show and hide
3	0.00000	0.25000	0.50000	-m_x,-m_y,-m_z	3.63000	-0.39000	-1.24000
(0,1/2,0)' + set click here to show and hide
4	0.00000	0.75000	0.00000	-m_x,-m_y,-m_z	3.63000	-0.39000	-1.24000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom Sr1_1:

Atom	x	y	z
1	0.99760	0.49440	0.37550
2	0.00240	0.50560	0.12450
(0,1/2,1/2) + set click here to show and hide
3	0.99760	0.99440	0.87550
4	0.00240	0.00560	0.62450
(0,0,1/2)' + set click here to show and hide
5	0.99760	0.49440	0.87550
6	0.00240	0.50560	0.62450
(0,1/2,0)' + set click here to show and hide
7	0.99760	0.99440	0.37550
8	0.00240	0.00560	0.12450

Set of atoms in the unit cell related by symmetry with the atom Sr1_2:

Atom	x	y	z
1	0.50240	0.74440	0.87450
2	0.49760	0.25560	0.62550
(0,1/2,1/2) + set click here to show and hide
3	0.50240	0.24440	0.37450
4	0.49760	0.75560	0.12550
(0,0,1/2)' + set click here to show and hide
5	0.50240	0.74440	0.37450
6	0.49760	0.25560	0.12550
(0,1/2,0)' + set click here to show and hide
7	0.50240	0.24440	0.87450
8	0.49760	0.75560	0.62550

Set of atoms in the unit cell related by symmetry with the atom W1_1:

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

Set of atoms in the unit cell related by symmetry with the atom W1_2:

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

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

Atom	x	y	z
1	0.28000	0.13050	0.01025
2	0.72000	0.86950	0.48975
(0,1/2,1/2) + set click here to show and hide
3	0.28000	0.63050	0.51025
4	0.72000	0.36950	0.98975
(0,0,1/2)' + set click here to show and hide
5	0.28000	0.13050	0.51025
6	0.72000	0.86950	0.98975
(0,1/2,0)' + set click here to show and hide
7	0.28000	0.63050	0.01025
8	0.72000	0.36950	0.48975

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

Atom	x	y	z
1	0.22000	0.38050	0.23975
2	0.78000	0.61950	0.26025
(0,1/2,1/2) + set click here to show and hide
3	0.22000	0.88050	0.73975
4	0.78000	0.11950	0.76025
(0,0,1/2)' + set click here to show and hide
5	0.22000	0.38050	0.73975
6	0.78000	0.61950	0.76025
(0,1/2,0)' + set click here to show and hide
7	0.22000	0.88050	0.23975
8	0.78000	0.11950	0.26025

Set of atoms in the unit cell related by symmetry with the atom O2_1:

Atom	x	y	z
1	0.24100	0.38900	0.01545
2	0.75900	0.61100	0.48455
(0,1/2,1/2) + set click here to show and hide
3	0.24100	0.88900	0.51545
4	0.75900	0.11100	0.98455
(0,0,1/2)' + set click here to show and hide
5	0.24100	0.38900	0.51545
6	0.75900	0.61100	0.98455
(0,1/2,0)' + set click here to show and hide
7	0.24100	0.88900	0.01545
8	0.75900	0.11100	0.48455

Set of atoms in the unit cell related by symmetry with the atom O2_2:

Atom	x	y	z
1	0.25900	0.63900	0.23455
2	0.74100	0.36100	0.26545
(0,1/2,1/2) + set click here to show and hide
3	0.25900	0.13900	0.73455
4	0.74100	0.86100	0.76545
(0,0,1/2)' + set click here to show and hide
5	0.25900	0.63900	0.73455
6	0.74100	0.36100	0.76545
(0,1/2,0)' + set click here to show and hide
7	0.25900	0.13900	0.23455
8	0.74100	0.86100	0.26545

Set of atoms in the unit cell related by symmetry with the atom O3_1:

Atom	x	y	z
1	0.04950	0.25350	0.36950
2	0.95050	0.74650	0.13050
(0,1/2,1/2) + set click here to show and hide
3	0.04950	0.75350	0.86950
4	0.95050	0.24650	0.63050
(0,0,1/2)' + set click here to show and hide
5	0.04950	0.25350	0.86950
6	0.95050	0.74650	0.63050
(0,1/2,0)' + set click here to show and hide
7	0.04950	0.75350	0.36950
8	0.95050	0.24650	0.13050

Set of atoms in the unit cell related by symmetry with the atom O3_2:

Atom	x	y	z
1	0.45050	0.50350	0.88050
2	0.54950	0.49650	0.61950
(0,1/2,1/2) + set click here to show and hide
3	0.45050	0.00350	0.38050
4	0.54950	0.99650	0.11950
(0,0,1/2)' + set click here to show and hide
5	0.45050	0.50350	0.38050
6	0.54950	0.49650	0.11950
(0,1/2,0)' + set click here to show and hide
7	0.45050	0.00350	0.88050
8	0.54950	0.99650	0.61950

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Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Fe1_1	Fe	0.50000	0.00000	0.25000	4	m_x,m_y,m_z	-3.63(6)	0.39(5)	1.24(9)	3.86
Fe1_2	Fe	0.00000	0.25000	0.00000	4	m_x,m_y,m_z	-3.63	0.39	1.24	3.86

label	dim. full irrep	dim. small irrep	direction	action	number of modes
mD1-D2-	2	2	general	primary	6

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