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+1/2,-y+3/4,-z+1/4,+1	{ 2₁₀₀ \| 1/2 3/4 1/4 }
3	-x,-y,-z,+1	{ -1 \| 0 }
4	-x+1/2,y+3/4,z+1/4,+1	{ m₁₀₀ \| 1/2 3/4 1/4 }
(0,1/2,1/2) + set click here to show and hide
5	x,y+1/2,z+1/2,+1	{ 1 \| 0 1/2 1/2 }
6	x+1/2,-y+1/4,-z+3/4,+1	{ 2₁₀₀ \| 1/2 1/4 3/4 }
7	-x,-y+1/2,-z+1/2,+1	{ -1 \| 0 1/2 1/2 }
8	-x+1/2,y+1/4,z+3/4,+1	{ m₁₀₀ \| 1/2 1/4 3/4 }
(0,1/2,0)' + set click here to show and hide
9	x,y+1/2,z,-1	{ 1' \| 0 1/2 0 }
10	x+1/2,-y+1/4,-z+1/4,-1	{ 2'₁₀₀ \| 1/2 1/4 1/4 }
11	-x,-y+1/2,-z,-1	{ -1' \| 0 1/2 0 }
12	-x+1/2,y+1/4,z+1/4,-1	{ m'₁₀₀ \| 1/2 1/4 1/4 }
(0,0,1/2)' + set click here to show and hide
13	x,y,z+1/2,-1	{ 1' \| 0 0 1/2 }
14	x+1/2,-y+3/4,-z+3/4,-1	{ 2'₁₀₀ \| 1/2 3/4 3/4 }
15	-x,-y,-z+1/2,-1	{ -1' \| 0 0 1/2 }
16	-x+1/2,y+3/4,z+3/4,-1	{ m'₁₀₀ \| 1/2 3/4 3/4 }

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N	(x,y,z)	Seitz notation
1	x,y,z,+1	1
2	x,-y,-z,+1	2₁₀₀
3	-x,-y,-z,+1	-1
4	-x,y,z,+1	m₁₀₀
1' + set click here to show and hide
5	x,y,z,-1	1'
6	x,-y,-z,-1	2'₁₀₀
7	-x,-y,-z,-1	-1'
8	-x,y,z,-1	m'₁₀₀

Magnetic atoms:

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Pr1	Pr	0.98190	0.12500	0.10085	16	m_x,m_y,m_z	0.0	3.38(6)	0.0	3.38

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
Pd1	Pd	0.20210	0.12500	0.29490	16
Sn1	Sn	0.81290	0.12500	0.29445	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 Pr1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.98190	0.12500	0.10085	m_x,m_y,m_z	0.00000	3.38000	0.00000
2	0.48190	0.62500	0.14915	m_x,-m_y,-m_z	0.00000	-3.38000	0.00000
3	0.01810	0.87500	0.89915	m_x,m_y,m_z	0.00000	3.38000	0.00000
4	0.51810	0.87500	0.35085	m_x,-m_y,-m_z	0.00000	-3.38000	0.00000
(0,1/2,1/2) + set click here to show and hide
5	0.98190	0.62500	0.60085	m_x,m_y,m_z	0.00000	3.38000	0.00000
6	0.48190	0.12500	0.64915	m_x,-m_y,-m_z	0.00000	-3.38000	0.00000
7	0.01810	0.37500	0.39915	m_x,m_y,m_z	0.00000	3.38000	0.00000
8	0.51810	0.37500	0.85085	m_x,-m_y,-m_z	0.00000	-3.38000	0.00000
(0,1/2,0)' + set click here to show and hide
9	0.98190	0.62500	0.10085	-m_x,-m_y,-m_z	0.00000	-3.38000	0.00000
10	0.48190	0.12500	0.14915	-m_x,m_y,m_z	0.00000	3.38000	0.00000
11	0.01810	0.37500	0.89915	-m_x,-m_y,-m_z	0.00000	-3.38000	0.00000
12	0.51810	0.37500	0.35085	-m_x,m_y,m_z	0.00000	3.38000	0.00000
(0,0,1/2)' + set click here to show and hide
13	0.98190	0.12500	0.60085	-m_x,-m_y,-m_z	0.00000	-3.38000	0.00000
14	0.48190	0.62500	0.64915	-m_x,m_y,m_z	0.00000	3.38000	0.00000
15	0.01810	0.87500	0.39915	-m_x,-m_y,-m_z	0.00000	-3.38000	0.00000
16	0.51810	0.87500	0.85085	-m_x,m_y,m_z	0.00000	3.38000	0.00000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom Pd1:

Atom	x	y	z
1	0.20210	0.12500	0.29490
2	0.70210	0.62500	0.95510
3	0.79790	0.87500	0.70510
4	0.29790	0.87500	0.54490
(0,1/2,1/2) + set click here to show and hide
5	0.20210	0.62500	0.79490
6	0.70210	0.12500	0.45510
7	0.79790	0.37500	0.20510
8	0.29790	0.37500	0.04490
(0,1/2,0)' + set click here to show and hide
9	0.20210	0.62500	0.29490
10	0.70210	0.12500	0.95510
11	0.79790	0.37500	0.70510
12	0.29790	0.37500	0.54490
(0,0,1/2)' + set click here to show and hide
13	0.20210	0.12500	0.79490
14	0.70210	0.62500	0.45510
15	0.79790	0.87500	0.20510
16	0.29790	0.87500	0.04490

Set of atoms in the unit cell related by symmetry with the atom Sn1:

Atom	x	y	z
1	0.81290	0.12500	0.29445
2	0.31290	0.62500	0.95555
3	0.18710	0.87500	0.70555
4	0.68710	0.87500	0.54445
(0,1/2,1/2) + set click here to show and hide
5	0.81290	0.62500	0.79445
6	0.31290	0.12500	0.45555
7	0.18710	0.37500	0.20555
8	0.68710	0.37500	0.04445
(0,1/2,0)' + set click here to show and hide
9	0.81290	0.62500	0.29445
10	0.31290	0.12500	0.95555
11	0.18710	0.37500	0.70555
12	0.68710	0.37500	0.54445
(0,0,1/2)' + set click here to show and hide
13	0.81290	0.12500	0.79445
14	0.31290	0.62500	0.45555
15	0.18710	0.87500	0.20555
16	0.68710	0.87500	0.04445

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Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Pr1	Pr	0.98190	0.12500	0.10085	16	m_x,m_y,m_z	0.0	3.38(6)	0.0	3.38

label	dim. full irrep	dim. small irrep	direction	action	number of modes
mT2	2	2	special	primary	3

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