MAGNDATA - Collection of Magnetic Structures

Transformation matrix from the setting of the parent structure (a_p,b_p,c_p) to the working setting (a,b,c):

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

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Transformation matrix from the working setting (a,b,c) to the standard setting of the magnetic space group (a_s,b_s,c_s):

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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	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
U1	U	0.00000	0.00000	0.00000	4	m_x,0,m_z	0.33	0.0	0.74	0.66
Cr1	Cr	0.00000	0.21900	0.25000	8	0,m_y,0	0.0	0.0	0.0	0.00

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
Si1	Si	0.40000	0.00000	0.38700	8

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	0.33000	0.00000	0.74000
(1/2,1/2,1/2) + set click here to show and hide
2	0.50000	0.50000	0.50000	m_x,0,m_z	0.33000	0.00000	0.74000
(0,0,1/2)' + set click here to show and hide
3	0.00000	0.00000	0.50000	-m_x,0,-m_z	-0.33000	0.00000	-0.74000
(1/2,1/2,0)' + set click here to show and hide
4	0.50000	0.50000	0.00000	-m_x,0,-m_z	-0.33000	0.00000	-0.74000

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.21900	0.25000	0,m_y,0	0.00000	0.00000	0.00000
2	0.00000	0.78100	0.75000	0,m_y,0	0.00000	0.00000	0.00000
(1/2,1/2,1/2) + set click here to show and hide
3	0.50000	0.71900	0.75000	0,m_y,0	0.00000	0.00000	0.00000
4	0.50000	0.28100	0.25000	0,m_y,0	0.00000	0.00000	0.00000
(0,0,1/2)' + set click here to show and hide
5	0.00000	0.21900	0.75000	0,-m_y,0	0.00000	0.00000	0.00000
6	0.00000	0.78100	0.25000	0,-m_y,0	0.00000	0.00000	0.00000
(1/2,1/2,0)' + set click here to show and hide
7	0.50000	0.71900	0.25000	0,-m_y,0	0.00000	0.00000	0.00000
8	0.50000	0.28100	0.75000	0,-m_y,0	0.00000	0.00000	0.00000

Atom	x	y	z
1	0.40000	0.00000	0.38700
2	0.60000	0.00000	0.11300
(1/2,1/2,1/2) + set click here to show and hide
3	0.90000	0.50000	0.88700
4	0.10000	0.50000	0.61300
(0,0,1/2)' + set click here to show and hide
5	0.40000	0.00000	0.88700
6	0.60000	0.00000	0.61300
(1/2,1/2,0)' + set click here to show and hide
7	0.90000	0.50000	0.38700
8	0.10000	0.50000	0.11300

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
U1	U	0.00000	0.00000	0.00000	4	m_x,0,m_z	0.33	0.0	0.74	0.66
Cr1	Cr	0.00000	0.21900	0.25000	8	0,m_y,0	0.0	0.0	0.0	0.00

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	0.33000	0.00000	0.74000
(1/2,1/2,1/2) + set click here to show and hide
2	0.50000	0.50000	0.50000	m_x,0,m_z	0.33000	0.00000	0.74000
(0,0,1/2)' + set click here to show and hide
3	0.00000	0.00000	0.50000	-m_x,0,-m_z	-0.33000	0.00000	-0.74000
(1/2,1/2,0)' + set click here to show and hide
4	0.50000	0.50000	0.00000	-m_x,0,-m_z	-0.33000	0.00000	-0.74000

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.21900	0.25000	0,m_y,0	0.00000	0.00000	0.00000
2	0.00000	0.78100	0.75000	0,m_y,0	0.00000	0.00000	0.00000
(1/2,1/2,1/2) + set click here to show and hide
3	0.50000	0.71900	0.75000	0,m_y,0	0.00000	0.00000	0.00000
4	0.50000	0.28100	0.25000	0,m_y,0	0.00000	0.00000	0.00000
(0,0,1/2)' + set click here to show and hide
5	0.00000	0.21900	0.75000	0,-m_y,0	0.00000	0.00000	0.00000
6	0.00000	0.78100	0.25000	0,-m_y,0	0.00000	0.00000	0.00000
(1/2,1/2,0)' + set click here to show and hide
7	0.50000	0.71900	0.25000	0,-m_y,0	0.00000	0.00000	0.00000
8	0.50000	0.28100	0.75000	0,-m_y,0	0.00000	0.00000	0.00000

label	dim. small irrep	dim. full irrep	action	number of modes
mM2+	1	1	primary	3

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