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 }
(1/2,1/4,3/4) + set click here to show and hide
5	x+1/2,y+1/4,z+3/4,+1	{ 1 \| 1/2 1/4 3/4 }
6	-x+1/2,-y+1/4,-z+1/4,+1	{ -1 \| 1/2 1/4 1/4 }
(1/2,3/4,1/4) + set click here to show and hide
7	x+1/2,y+3/4,z+1/4,+1	{ 1 \| 1/2 3/4 1/4 }
8	-x+1/2,-y+3/4,-z+3/4,+1	{ -1 \| 1/2 3/4 3/4 }
(1/2,1/4,1/4)' + set click here to show and hide
9	x+1/2,y+1/4,z+1/4,-1	{ 1' \| 1/2 1/4 1/4 }
10	-x+1/2,-y+1/4,-z+3/4,-1	{ -1' \| 1/2 1/4 3/4 }
(1/2,3/4,3/4)' + set click here to show and hide
11	x+1/2,y+3/4,z+3/4,-1	{ 1' \| 1/2 3/4 3/4 }
12	-x+1/2,-y+3/4,-z+1/4,-1	{ -1' \| 1/2 3/4 1/4 }
(0,1/2,0)' + set click here to show and hide
13	x,y+1/2,z,-1	{ 1' \| 0 1/2 0 }
14	-x,-y+1/2,-z+1/2,-1	{ -1' \| 0 1/2 1/2 }
(0,0,1/2)' + set click here to show and hide
15	x,y,z+1/2,-1	{ 1' \| 0 0 1/2 }
16	-x,-y,-z,-1	{ -1' \| 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\|
Cu1	Cu	0.00000	0.00000	0.25000	8	m_x,m_y,m_z	0.57(1)	0.0	0.0	0.57

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
Sr1	Sr	0.00000	0.25000	0.12500	16
W1	W	0.00000	0.00000	0.00000	8
O1_1	O	0.28900	0.10075	0.00000	16
O1_2	O	0.79850	0.14450	0.00000	16
O2	O	0.00000	0.00000	0.11385	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 Cu1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.00000	0.25000	m_x,m_y,m_z	0.57000	0.00000	0.00000
(0,1/2,1/2) + set click here to show and hide
2	0.00000	0.50000	0.75000	m_x,m_y,m_z	0.57000	0.00000	0.00000
(1/2,1/4,3/4) + set click here to show and hide
3	0.50000	0.25000	0.00000	m_x,m_y,m_z	0.57000	0.00000	0.00000
(1/2,3/4,1/4) + set click here to show and hide
4	0.50000	0.75000	0.50000	m_x,m_y,m_z	0.57000	0.00000	0.00000
(1/2,1/4,1/4)' + set click here to show and hide
5	0.50000	0.25000	0.50000	-m_x,-m_y,-m_z	-0.57000	0.00000	0.00000
(1/2,3/4,3/4)' + set click here to show and hide
6	0.50000	0.75000	0.00000	-m_x,-m_y,-m_z	-0.57000	0.00000	0.00000
(0,1/2,0)' + set click here to show and hide
7	0.00000	0.50000	0.25000	-m_x,-m_y,-m_z	-0.57000	0.00000	0.00000
(0,0,1/2)' + set click here to show and hide
8	0.00000	0.00000	0.75000	-m_x,-m_y,-m_z	-0.57000	0.00000	0.00000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom Sr1:

Atom	x	y	z
1	0.00000	0.25000	0.12500
2	0.00000	0.75000	0.37500
(0,1/2,1/2) + set click here to show and hide
3	0.00000	0.75000	0.62500
4	0.00000	0.25000	0.87500
(1/2,1/4,3/4) + set click here to show and hide
5	0.50000	0.50000	0.87500
6	0.50000	0.00000	0.12500
(1/2,3/4,1/4) + set click here to show and hide
7	0.50000	0.00000	0.37500
8	0.50000	0.50000	0.62500
(1/2,1/4,1/4)' + set click here to show and hide
9	0.50000	0.50000	0.37500
10	0.50000	0.00000	0.62500
(1/2,3/4,3/4)' + set click here to show and hide
11	0.50000	0.00000	0.87500
12	0.50000	0.50000	0.12500
(0,1/2,0)' + set click here to show and hide
13	0.00000	0.75000	0.12500
14	0.00000	0.25000	0.37500
(0,0,1/2)' + set click here to show and hide
15	0.00000	0.25000	0.62500
16	0.00000	0.75000	0.87500

Set of atoms in the unit cell related by symmetry with the atom W1:

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

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

Atom	x	y	z
1	0.28900	0.10075	0.00000
2	0.71100	0.89925	0.50000
(0,1/2,1/2) + set click here to show and hide
3	0.28900	0.60075	0.50000
4	0.71100	0.39925	0.00000
(1/2,1/4,3/4) + set click here to show and hide
5	0.78900	0.35075	0.75000
6	0.21100	0.14925	0.25000
(1/2,3/4,1/4) + set click here to show and hide
7	0.78900	0.85075	0.25000
8	0.21100	0.64925	0.75000
(1/2,1/4,1/4)' + set click here to show and hide
9	0.78900	0.35075	0.25000
10	0.21100	0.14925	0.75000
(1/2,3/4,3/4)' + set click here to show and hide
11	0.78900	0.85075	0.75000
12	0.21100	0.64925	0.25000
(0,1/2,0)' + set click here to show and hide
13	0.28900	0.60075	0.00000
14	0.71100	0.39925	0.50000
(0,0,1/2)' + set click here to show and hide
15	0.28900	0.10075	0.50000
16	0.71100	0.89925	0.00000

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

Atom	x	y	z
1	0.79850	0.14450	0.00000
2	0.20150	0.85550	0.50000
(0,1/2,1/2) + set click here to show and hide
3	0.79850	0.64450	0.50000
4	0.20150	0.35550	0.00000
(1/2,1/4,3/4) + set click here to show and hide
5	0.29850	0.39450	0.75000
6	0.70150	0.10550	0.25000
(1/2,3/4,1/4) + set click here to show and hide
7	0.29850	0.89450	0.25000
8	0.70150	0.60550	0.75000
(1/2,1/4,1/4)' + set click here to show and hide
9	0.29850	0.39450	0.25000
10	0.70150	0.10550	0.75000
(1/2,3/4,3/4)' + set click here to show and hide
11	0.29850	0.89450	0.75000
12	0.70150	0.60550	0.25000
(0,1/2,0)' + set click here to show and hide
13	0.79850	0.64450	0.00000
14	0.20150	0.35550	0.50000
(0,0,1/2)' + set click here to show and hide
15	0.79850	0.14450	0.50000
16	0.20150	0.85550	0.00000

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

Atom	x	y	z
1	0.00000	0.00000	0.11385
2	0.00000	0.00000	0.38615
(0,1/2,1/2) + set click here to show and hide
3	0.00000	0.50000	0.61385
4	0.00000	0.50000	0.88615
(1/2,1/4,3/4) + set click here to show and hide
5	0.50000	0.25000	0.86385
6	0.50000	0.25000	0.13615
(1/2,3/4,1/4) + set click here to show and hide
7	0.50000	0.75000	0.36385
8	0.50000	0.75000	0.63615
(1/2,1/4,1/4)' + set click here to show and hide
9	0.50000	0.25000	0.36385
10	0.50000	0.25000	0.63615
(1/2,3/4,3/4)' + set click here to show and hide
11	0.50000	0.75000	0.86385
12	0.50000	0.75000	0.13615
(0,1/2,0)' + set click here to show and hide
13	0.00000	0.50000	0.11385
14	0.00000	0.50000	0.38615
(0,0,1/2)' + set click here to show and hide
15	0.00000	0.00000	0.61385
16	0.00000	0.00000	0.88615

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Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Cu1	Cu	0.00000	0.00000	0.25000	8	m_x,m_y,m_z	0.57(1)	0.0	0.0	0.57

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