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+1/2,-y+1/2,z+1/2,+1	{ 2₀₀₁ \| 1/2 1/2 1/2 }
3	-x+1/2,-y+1/2,-z,+1	{ -1 \| 1/2 1/2 0 }
4	x,y,-z+1/2,+1	{ m₀₀₁ \| 0 0 1/2 }
(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,-y,z+1/2,-1	{ 2'₀₀₁ \| 0 0 1/2 }
7	-x,-y,-z,-1	{ -1' \| 0 }
8	x+1/2,y+1/2,-z+1/2,-1	{ m'₀₀₁ \| 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	2₀₀₁
3	-x,-y,-z,+1	-1
4	x,y,-z,+1	m₀₀₁
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5	x,y,z,-1	1'
6	-x,-y,z,-1	2'₀₀₁
7	-x,-y,-z,-1	-1'
8	x,y,-z,-1	m'₀₀₁

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Magnetic atoms:

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Dy1	Dy	0.00000	0.3336(9)	0.0987(9)	8	m_x,m_y,m_z	7.36(8)	0.0	0.0	7.36
Dy2	Dy	0.00000	0.055(2)	0.25000	4	0,0,m_z	0.0	0.0	-5.7(3)	5.70

Non-magnetic atoms:

Label	Atom type	y	z	Multiplicity
Ge1	Ge	0.353(5)	0.888(2)	8
Ge2	Ge	0.789(6)	0.25000	4
Ge3	Ge	0.00000	0.00000	4

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.33360	0.09870	m_x,m_y,m_z	7.36000	0.00000	0.00000
2	0.50000	0.16640	0.59870	-m_x,-m_y,m_z	-7.36000	0.00000	0.00000
3	0.50000	0.16640	0.90130	m_x,m_y,m_z	7.36000	0.00000	0.00000
4	0.00000	0.33360	0.40130	-m_x,-m_y,m_z	-7.36000	0.00000	0.00000
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5	0.50000	0.83360	0.09870	-m_x,-m_y,-m_z	-7.36000	0.00000	0.00000
6	0.00000	0.66640	0.59870	m_x,m_y,-m_z	7.36000	0.00000	0.00000
7	0.00000	0.66640	0.90130	-m_x,-m_y,-m_z	-7.36000	0.00000	0.00000
8	0.50000	0.83360	0.40130	m_x,m_y,-m_z	7.36000	0.00000	0.00000

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.05500	0.25000	0,0,m_z	0.00000	0.00000	-5.70000
2	0.50000	0.44500	0.75000	0,0,m_z	0.00000	0.00000	-5.70000
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3	0.50000	0.55500	0.25000	0,0,-m_z	0.00000	0.00000	5.70000
4	0.00000	0.94500	0.75000	0,0,-m_z	0.00000	0.00000	5.70000

Atom	x	y	z
1	0.00000	0.35300	0.88800
2	0.50000	0.14700	0.38800
3	0.50000	0.14700	0.11200
4	0.00000	0.35300	0.61200
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5	0.50000	0.85300	0.88800
6	0.00000	0.64700	0.38800
7	0.00000	0.64700	0.11200
8	0.50000	0.85300	0.61200

Atom	x	y	z
1	0.00000	0.78900	0.25000
2	0.50000	0.71100	0.75000
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3	0.50000	0.28900	0.25000
4	0.00000	0.21100	0.75000

Atom	x	y	z
1	0.00000	0.00000	0.00000
2	0.50000	0.50000	0.50000
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3	0.50000	0.50000	0.00000
4	0.00000	0.00000	0.50000

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Dy1	Dy	0.00000	0.3336(9)	0.0987(9)	8	m_x,m_y,m_z	7.36(8)	0.0	0.0	7.36
Dy2	Dy	0.00000	0.055(2)	0.25000	4	0,0,m_z	0.0	0.0	-5.7(3)	5.70

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.33360	0.09870	m_x,m_y,m_z	7.36000	0.00000	0.00000
2	0.50000	0.16640	0.59870	-m_x,-m_y,m_z	-7.36000	0.00000	0.00000
3	0.50000	0.16640	0.90130	m_x,m_y,m_z	7.36000	0.00000	0.00000
4	0.00000	0.33360	0.40130	-m_x,-m_y,m_z	-7.36000	0.00000	0.00000
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5	0.50000	0.83360	0.09870	-m_x,-m_y,-m_z	-7.36000	0.00000	0.00000
6	0.00000	0.66640	0.59870	m_x,m_y,-m_z	7.36000	0.00000	0.00000
7	0.00000	0.66640	0.90130	-m_x,-m_y,-m_z	-7.36000	0.00000	0.00000
8	0.50000	0.83360	0.40130	m_x,m_y,-m_z	7.36000	0.00000	0.00000

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.05500	0.25000	0,0,m_z	0.00000	0.00000	-5.70000
2	0.50000	0.44500	0.75000	0,0,m_z	0.00000	0.00000	-5.70000
(1/2,1/2,0)' + set click here to show and hide
3	0.50000	0.55500	0.25000	0,0,-m_z	0.00000	0.00000	5.70000
4	0.00000	0.94500	0.75000	0,0,-m_z	0.00000	0.00000	5.70000

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