MAGNDATA - Collection of Magnetic Structures

N	(x,y,z)	Seitz notation
1	x,y,z,+1	{ 1 \| 0 }
2	x,-y,z+1/2,+1	{ m₀₁₀ \| 0 0 1/2 }
(0,0,1/2)' + set click here to show and hide
3	x,y,z+1/2,-1	{ 1' \| 0 0 1/2 }
4	x,-y,z,-1	{ m'₀₁₀ \| 0 }

N	(x,y,z)	Seitz notation
1	x,y,z,+1	1
2	x,-y,z,+1	m₀₁₀
1' + set click here to show and hide
3	x,y,z,-1	1'
4	x,-y,z,-1	m'₀₁₀

Magnetic atoms:

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_z	\|M\|
Nd1_1	Nd	0.86174	0	0.68087	2	m_x,0,m_z	0.4(3)	1.73(2)	1.69
Nd1_2	Nd	0.36174	0	-0.06913	2	m_x,0,m_z	-0.67(9)	1.41(6)	1.69
Nd1_3	Nd	0.13826	0.5	0.06913	2	m_x,0,m_z	0.78(8)	-1.33(6)	1.69
Nd1_4	Nd	0.63826	0.5	0.31913	2	m_x,0,m_z	0.28(16)	1.73(3)	1.69

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
Sb1_1	Sb	0	0	0	2
Sb1_2	Sb	0.5	0	0.25	2
Sb1_3	Sb	0	0.5	0.75	2
Sb1_4	Sb	0.5	0.5	0	2
Te1_1	Te	0.18712	0	0.84356	2
Te1_2	Te	0.68712	0	0.09356	2
Te1_3	Te	0.81288	0.5	-0.09356	2
Te1_4	Te	0.31288	0.5	0.15644	2

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 Nd1_1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.86174	0.00000	0.68087	m_x,0,m_z	0.40000	0.00000	1.73000
(0,0,1/2)' + set click here to show and hide
2	0.86174	0.00000	0.18087	-m_x,0,-m_z	-0.40000	0.00000	-1.73000

Set of atoms in the unit cell related by symmetry with the magnetic atom Nd1_2:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.36174	0.00000	0.93087	m_x,0,m_z	-0.67000	0.00000	1.41000
(0,0,1/2)' + set click here to show and hide
2	0.36174	0.00000	0.43087	-m_x,0,-m_z	0.67000	0.00000	-1.41000

Set of atoms in the unit cell related by symmetry with the magnetic atom Nd1_3:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.13826	0.50000	0.06913	m_x,0,m_z	0.78000	0.00000	-1.33000
(0,0,1/2)' + set click here to show and hide
2	0.13826	0.50000	0.56913	-m_x,0,-m_z	-0.78000	0.00000	1.33000

Set of atoms in the unit cell related by symmetry with the magnetic atom Nd1_4:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.63826	0.50000	0.31913	m_x,0,m_z	0.28000	0.00000	1.73000
(0,0,1/2)' + set click here to show and hide
2	0.63826	0.50000	0.81913	-m_x,0,-m_z	-0.28000	0.00000	-1.73000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom Sb1_1:

Atom	x	y	z
1	0.00000	0.00000	0.00000
(0,0,1/2)' + set click here to show and hide
2	0.00000	0.00000	0.50000

Set of atoms in the unit cell related by symmetry with the atom Sb1_2:

Atom	x	y	z
1	0.50000	0.00000	0.25000
(0,0,1/2)' + set click here to show and hide
2	0.50000	0.00000	0.75000

Set of atoms in the unit cell related by symmetry with the atom Sb1_3:

Atom	x	y	z
1	0.00000	0.50000	0.75000
(0,0,1/2)' + set click here to show and hide
2	0.00000	0.50000	0.25000

Set of atoms in the unit cell related by symmetry with the atom Sb1_4:

Atom	x	y	z
1	0.50000	0.50000	0.00000
(0,0,1/2)' + set click here to show and hide
2	0.50000	0.50000	0.50000

Set of atoms in the unit cell related by symmetry with the atom Te1_1:

Atom	x	y	z
1	0.18712	0.00000	0.84356
(0,0,1/2)' + set click here to show and hide
2	0.18712	0.00000	0.34356

Set of atoms in the unit cell related by symmetry with the atom Te1_2:

Atom	x	y	z
1	0.68712	0.00000	0.09356
(0,0,1/2)' + set click here to show and hide
2	0.68712	0.00000	0.59356

Set of atoms in the unit cell related by symmetry with the atom Te1_3:

Atom	x	y	z
1	0.81288	0.50000	0.90644
(0,0,1/2)' + set click here to show and hide
2	0.81288	0.50000	0.40644

Set of atoms in the unit cell related by symmetry with the atom Te1_4:

Atom	x	y	z
1	0.31288	0.50000	0.15644
(0,0,1/2)' + set click here to show and hide
2	0.31288	0.50000	0.65644

[Hide]

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_z	\|M\|
Nd1_1	Nd	0.86174	0	0.68087	2	m_x,0,m_z	0.4(3)	1.73(2)	1.69
Nd1_2	Nd	0.36174	0	-0.06913	2	m_x,0,m_z	-0.67(9)	1.41(6)	1.69
Nd1_3	Nd	0.13826	0.5	0.06913	2	m_x,0,m_z	0.78(8)	-1.33(6)	1.69
Nd1_4	Nd	0.63826	0.5	0.31913	2	m_x,0,m_z	0.28(16)	1.73(3)	1.69

label	dim. full irrep	dim. small irrep	direction	action	number of modes
mW2W4	8	4	general	primary	8

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