MAGNDATA - Collection of Magnetic Structures

N	(x,y,z)	Seitz notation
1	x,y,z,+1	{ 1 \| 0 }
2	-x,y,-z,-1	{ 2'₀₁₀ \| 0 }
3	-x,-y,-z,+1	{ -1 \| 0 }
4	x,-y,z,-1	{ m'₀₁₀ \| 0 }
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5	x+1/2,y+1/2,z,+1	{ 1 \| 1/2 1/2 0 }
6	-x+1/2,y+1/2,-z,-1	{ 2'₀₁₀ \| 1/2 1/2 0 }
7	-x+1/2,-y+1/2,-z,+1	{ -1 \| 1/2 1/2 0 }
8	x+1/2,-y+1/2,z,-1	{ m'₀₁₀ \| 1/2 1/2 0 }

Magnetic atoms:

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Pr1_1	Pr	0.00000	0.00000	0.00000	2	m_x,0,m_z	0.85(23)	0.0	1.3(18)	1.55
Pr1_2	Pr	0.00000	0.66667	0.00000	4	m_x,0,m_z	1.98(17)	0.0	1.19(92)	2.31
Pr1_3	Pr	0.00000	0.00000	0.50000	2	m_x,0,m_z	0.85(23)	0.0	1.3(18)	1.55
Pr1_4	Pr	0.00000	0.66667	0.50000	4	m_x,0,m_z	1.98(17)	0.0	1.19(92)	2.31
Pr2_1	Pr	0.66667	0.00000	0.75000	4	m_x,0,m_z	0.40(17)	0.0	3.21(58)	3.23
Pr2_2	Pr	0.16667	0.16667	0.75000	8	m_x,m_y,m_z	-0.202(85)	0.35(15)	2.70(31)	2.73

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
In1	In	0.66667	0.00000	0.25000	4
In2	In	0.16667	0.16667	0.25000	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 Pr1_1:

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	0.85000	0.00000	1.30000
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2	0.50000	0.50000	0.00000	m_x,0,m_z	0.85000	0.00000	1.30000

Set of atoms in the unit cell related by symmetry with the magnetic atom Pr1_2:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.66667	0.00000	m_x,0,m_z	1.98000	0.00000	1.19000
2	0.00000	0.33333	0.00000	m_x,0,m_z	1.98000	0.00000	1.19000
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3	0.50000	0.16667	0.00000	m_x,0,m_z	1.98000	0.00000	1.19000
4	0.50000	0.83333	0.00000	m_x,0,m_z	1.98000	0.00000	1.19000

Set of atoms in the unit cell related by symmetry with the magnetic atom Pr1_3:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.00000	0.50000	m_x,0,m_z	0.85000	0.00000	1.30000
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2	0.50000	0.50000	0.50000	m_x,0,m_z	0.85000	0.00000	1.30000

Set of atoms in the unit cell related by symmetry with the magnetic atom Pr1_4:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.66667	0.50000	m_x,0,m_z	1.98000	0.00000	1.19000
2	0.00000	0.33333	0.50000	m_x,0,m_z	1.98000	0.00000	1.19000
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3	0.50000	0.16667	0.50000	m_x,0,m_z	1.98000	0.00000	1.19000
4	0.50000	0.83333	0.50000	m_x,0,m_z	1.98000	0.00000	1.19000

Set of atoms in the unit cell related by symmetry with the magnetic atom Pr2_1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.66667	0.00000	0.75000	m_x,0,m_z	0.40000	0.00000	3.21000
2	0.33333	0.00000	0.25000	m_x,0,m_z	0.40000	0.00000	3.21000
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3	0.16667	0.50000	0.75000	m_x,0,m_z	0.40000	0.00000	3.21000
4	0.83333	0.50000	0.25000	m_x,0,m_z	0.40000	0.00000	3.21000

Set of atoms in the unit cell related by symmetry with the magnetic atom Pr2_2:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.16667	0.16667	0.75000	m_x,m_y,m_z	-0.20200	0.35000	2.70000
2	0.83333	0.16667	0.25000	m_x,-m_y,m_z	-0.20200	-0.35000	2.70000
3	0.83333	0.83333	0.25000	m_x,m_y,m_z	-0.20200	0.35000	2.70000
4	0.16667	0.83333	0.75000	m_x,-m_y,m_z	-0.20200	-0.35000	2.70000
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5	0.66667	0.66667	0.75000	m_x,m_y,m_z	-0.20200	0.35000	2.70000
6	0.33333	0.66667	0.25000	m_x,-m_y,m_z	-0.20200	-0.35000	2.70000
7	0.33333	0.33333	0.25000	m_x,m_y,m_z	-0.20200	0.35000	2.70000
8	0.66667	0.33333	0.75000	m_x,-m_y,m_z	-0.20200	-0.35000	2.70000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom In1:

Atom	x	y	z
1	0.66667	0.00000	0.25000
2	0.33333	0.00000	0.75000
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3	0.16667	0.50000	0.25000
4	0.83333	0.50000	0.75000

Set of atoms in the unit cell related by symmetry with the atom In2:

Atom	x	y	z
1	0.16667	0.16667	0.25000
2	0.83333	0.16667	0.75000
3	0.83333	0.83333	0.75000
4	0.16667	0.83333	0.25000
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5	0.66667	0.66667	0.25000
6	0.33333	0.66667	0.75000
7	0.33333	0.33333	0.75000
8	0.66667	0.33333	0.25000

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Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Pr1_1	Pr	0.00000	0.00000	0.00000	2	m_x,0,m_z	0.85(23)	0.0	1.3(18)	1.55
Pr1_2	Pr	0.00000	0.66667	0.00000	4	m_x,0,m_z	1.98(17)	0.0	1.19(92)	2.31
Pr1_3	Pr	0.00000	0.00000	0.50000	2	m_x,0,m_z	0.85(23)	0.0	1.3(18)	1.55
Pr1_4	Pr	0.00000	0.66667	0.50000	4	m_x,0,m_z	1.98(17)	0.0	1.19(92)	2.31
Pr2_1	Pr	0.66667	0.00000	0.75000	4	m_x,0,m_z	0.40(17)	0.0	3.21(58)	3.23
Pr2_2	Pr	0.16667	0.16667	0.75000	8	m_x,m_y,m_z	-0.202(85)	0.35(15)	2.70(31)	2.73

Positions and magnetic moments of all atoms in unit cell, with magnetic moment relations explicitly given: