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

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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\|
Pr1	Pr	0.00000	0.00000	0.335(1)	4	m_x,0,m_z	1.53	0.0	0.95	1.80

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
Mg1_1	Mg	0.00000	0.50000	0.00000	2
Mg1_2	Mg	0.50000	0.00000	0.00000	2
Pb1	Pb	0.00000	0.00000	0.134(1)	4

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.00000	0.33500	m_x,0,m_z	1.53000	0.00000	0.95000
2	0.00000	0.00000	0.66500	-m_x,0,-m_z	-1.53000	0.00000	-0.95000
(1/2,1/2,1/2)' + set click here to show and hide
3	0.50000	0.50000	0.83500	-m_x,0,-m_z	-1.53000	0.00000	-0.95000
4	0.50000	0.50000	0.16500	m_x,0,m_z	1.53000	0.00000	0.95000

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

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

Atom	x	y	z
1	0.00000	0.00000	0.13400
2	0.00000	0.00000	0.86600
(1/2,1/2,1/2)' + set click here to show and hide
3	0.50000	0.50000	0.63400
4	0.50000	0.50000	0.36600

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Pr1	Pr	0.00000	0.00000	0.335(1)	4	m_x,0,m_z	1.53	0.0	0.95	1.80

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.00000	0.33500	m_x,0,m_z	1.53000	0.00000	0.95000
2	0.00000	0.00000	0.66500	-m_x,0,-m_z	-1.53000	0.00000	-0.95000
(1/2,1/2,1/2)' + set click here to show and hide
3	0.50000	0.50000	0.83500	-m_x,0,-m_z	-1.53000	0.00000	-0.95000
4	0.50000	0.50000	0.16500	m_x,0,m_z	1.53000	0.00000	0.95000

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