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,y,-z+1/2,+1	{ 2₀₁₀ \| 0 0 1/2 }
3	-x,-y,-z,+1	{ -1 \| 0 }
4	x,-y,z+1/2,+1	{ m₀₁₀ \| 0 0 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	{ 2₀₁₀ \| 1/2 1/2 0 }
7	-x+1/2,-y+1/2,-z+1/2,+1	{ -1 \| 1/2 1/2 1/2 }
8	x+1/2,-y+1/2,z,+1	{ m₀₁₀ \| 1/2 1/2 0 }
(0,0,1/2)' + set click here to show and hide
9	x,y,z+1/2,-1	{ 1' \| 0 0 1/2 }
10	-x,y,-z,-1	{ 2'₀₁₀ \| 0 }
11	-x,-y,-z+1/2,-1	{ -1' \| 0 0 1/2 }
12	x,-y,z,-1	{ m'₀₁₀ \| 0 }
(1/2,1/2,0)' + set click here to show and hide
13	x+1/2,y+1/2,z,-1	{ 1' \| 1/2 1/2 0 }
14	-x+1/2,y+1/2,-z+1/2,-1	{ 2'₀₁₀ \| 1/2 1/2 1/2 }
15	-x+1/2,-y+1/2,-z,-1	{ -1' \| 1/2 1/2 0 }
16	x+1/2,-y+1/2,z+1/2,-1	{ m'₀₁₀ \| 1/2 1/2 1/2 }

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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

Magnetic atoms:

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Dy1_1	Dy	0.09628	0.28884	0.125	16	m_x,m_y,m_z	0.01(5)	-0.18(9)	0.5(2)	0.53
Dy1_2	Dy	0.30744	0.5	0.625	8	m_x,0,m_z	-0.5(2)	0.0	-0.5(2)	0.71

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
Ru1_1	Ru	0.25000	0.75000	0.00000	8
Ru1_2	Ru	0.00000	0.50000	0.00000	4
Ru1_3	Ru	0.25000	0.75000	0.25000	8
Ru1_4	Ru	0.00000	0.50000	0.25000	4
Ru2_1	Ru	0.00000	0.00000	0.00000	4
Ru2_2	Ru	0.00000	0.00000	0.25000	4
Al1_1	Al	-0.33756	0.5	0.53812	8
Al1_2	Al	0.16244	0	0.21188	8
Al1_3	Al	0.41878	-0.25634	0.53812	16
Al1_4	Al	-0.08122	0.75634	0.21188	16
Al2_1	Al	-0.219325	0.342025	0.625	16
Al2_2	Al	-0.06135	0.5	0.125	8
Al3_1	Al	-0.166667	0.5	0.492399	8
Al3_2	Al	-0.166666	0.5	0.757601	8
Al4	Al	0.00000	0.00000	0.12500	8

[Show all atoms in unit cell and their moment relations]

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 Dy1_1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.09628	0.28884	0.12500	m_x,m_y,m_z	0.01000	-0.18000	0.50000
2	0.90372	0.28884	0.37500	-m_x,m_y,-m_z	-0.01000	-0.18000	-0.50000
3	0.90372	0.71116	0.87500	m_x,m_y,m_z	0.01000	-0.18000	0.50000
4	0.09628	0.71116	0.62500	-m_x,m_y,-m_z	-0.01000	-0.18000	-0.50000
(1/2,1/2,1/2) + set click here to show and hide
5	0.59628	0.78884	0.62500	m_x,m_y,m_z	0.01000	-0.18000	0.50000
6	0.40372	0.78884	0.87500	-m_x,m_y,-m_z	-0.01000	-0.18000	-0.50000
7	0.40372	0.21116	0.37500	m_x,m_y,m_z	0.01000	-0.18000	0.50000
8	0.59628	0.21116	0.12500	-m_x,m_y,-m_z	-0.01000	-0.18000	-0.50000
(0,0,1/2)' + set click here to show and hide
9	0.09628	0.28884	0.62500	-m_x,-m_y,-m_z	-0.01000	0.18000	-0.50000
10	0.90372	0.28884	0.87500	m_x,-m_y,m_z	0.01000	0.18000	0.50000
11	0.90372	0.71116	0.37500	-m_x,-m_y,-m_z	-0.01000	0.18000	-0.50000
12	0.09628	0.71116	0.12500	m_x,-m_y,m_z	0.01000	0.18000	0.50000
(1/2,1/2,0)' + set click here to show and hide
13	0.59628	0.78884	0.12500	-m_x,-m_y,-m_z	-0.01000	0.18000	-0.50000
14	0.40372	0.78884	0.37500	m_x,-m_y,m_z	0.01000	0.18000	0.50000
15	0.40372	0.21116	0.87500	-m_x,-m_y,-m_z	-0.01000	0.18000	-0.50000
16	0.59628	0.21116	0.62500	m_x,-m_y,m_z	0.01000	0.18000	0.50000

Set of atoms in the unit cell related by symmetry with the magnetic atom Dy1_2:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.30744	0.50000	0.62500	m_x,0,m_z	-0.50000	0.00000	-0.50000
2	0.69256	0.50000	0.87500	-m_x,0,-m_z	0.50000	0.00000	0.50000
(1/2,1/2,1/2) + set click here to show and hide
3	0.80744	0.00000	0.12500	m_x,0,m_z	-0.50000	0.00000	-0.50000
4	0.19256	0.00000	0.37500	-m_x,0,-m_z	0.50000	0.00000	0.50000
(0,0,1/2)' + set click here to show and hide
5	0.30744	0.50000	0.12500	-m_x,0,-m_z	0.50000	0.00000	0.50000
6	0.69256	0.50000	0.37500	m_x,0,m_z	-0.50000	0.00000	-0.50000
(1/2,1/2,0)' + set click here to show and hide
7	0.80744	0.00000	0.62500	-m_x,0,-m_z	0.50000	0.00000	0.50000
8	0.19256	0.00000	0.87500	m_x,0,m_z	-0.50000	0.00000	-0.50000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom Ru1_1:

Atom	x	y	z
1	0.25000	0.75000	0.00000
2	0.75000	0.75000	0.50000
(1/2,1/2,1/2) + set click here to show and hide
3	0.75000	0.25000	0.50000
4	0.25000	0.25000	0.00000
(0,0,1/2)' + set click here to show and hide
5	0.25000	0.75000	0.50000
6	0.75000	0.75000	0.00000
(1/2,1/2,0)' + set click here to show and hide
7	0.75000	0.25000	0.00000
8	0.25000	0.25000	0.50000

Set of atoms in the unit cell related by symmetry with the atom Ru1_2:

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
(0,0,1/2)' + set click here to show and hide
3	0.00000	0.50000	0.50000
(1/2,1/2,0)' + set click here to show and hide
4	0.50000	0.00000	0.00000

Set of atoms in the unit cell related by symmetry with the atom Ru1_3:

Atom	x	y	z
1	0.25000	0.75000	0.25000
2	0.75000	0.75000	0.25000
(1/2,1/2,1/2) + set click here to show and hide
3	0.75000	0.25000	0.75000
4	0.25000	0.25000	0.75000
(0,0,1/2)' + set click here to show and hide
5	0.25000	0.75000	0.75000
6	0.75000	0.75000	0.75000
(1/2,1/2,0)' + set click here to show and hide
7	0.75000	0.25000	0.25000
8	0.25000	0.25000	0.25000

Set of atoms in the unit cell related by symmetry with the atom Ru1_4:

Atom	x	y	z
1	0.00000	0.50000	0.25000
(1/2,1/2,1/2) + set click here to show and hide
2	0.50000	0.00000	0.75000
(0,0,1/2)' + set click here to show and hide
3	0.00000	0.50000	0.75000
(1/2,1/2,0)' + set click here to show and hide
4	0.50000	0.00000	0.25000

Set of atoms in the unit cell related by symmetry with the atom Ru2_1:

Atom	x	y	z
1	0.00000	0.00000	0.00000
(1/2,1/2,1/2) + set click here to show and hide
2	0.50000	0.50000	0.50000
(0,0,1/2)' + set click here to show and hide
3	0.00000	0.00000	0.50000
(1/2,1/2,0)' + set click here to show and hide
4	0.50000	0.50000	0.00000

Set of atoms in the unit cell related by symmetry with the atom Ru2_2:

Atom	x	y	z
1	0.00000	0.00000	0.25000
(1/2,1/2,1/2) + set click here to show and hide
2	0.50000	0.50000	0.75000
(0,0,1/2)' + set click here to show and hide
3	0.00000	0.00000	0.75000
(1/2,1/2,0)' + set click here to show and hide
4	0.50000	0.50000	0.25000

Set of atoms in the unit cell related by symmetry with the atom Al1_1:

Atom	x	y	z
1	0.66244	0.50000	0.53812
2	0.33756	0.50000	0.96188
(1/2,1/2,1/2) + set click here to show and hide
3	0.16244	0.00000	0.03812
4	0.83756	0.00000	0.46188
(0,0,1/2)' + set click here to show and hide
5	0.66244	0.50000	0.03812
6	0.33756	0.50000	0.46188
(1/2,1/2,0)' + set click here to show and hide
7	0.16244	0.00000	0.53812
8	0.83756	0.00000	0.96188

Set of atoms in the unit cell related by symmetry with the atom Al1_2:

Atom	x	y	z
1	0.16244	0.00000	0.21188
2	0.83756	0.00000	0.28812
(1/2,1/2,1/2) + set click here to show and hide
3	0.66244	0.50000	0.71188
4	0.33756	0.50000	0.78812
(0,0,1/2)' + set click here to show and hide
5	0.16244	0.00000	0.71188
6	0.83756	0.00000	0.78812
(1/2,1/2,0)' + set click here to show and hide
7	0.66244	0.50000	0.21188
8	0.33756	0.50000	0.28812

Set of atoms in the unit cell related by symmetry with the atom Al1_3:

Atom	x	y	z
1	0.41878	0.74366	0.53812
2	0.58122	0.74366	0.96188
3	0.58122	0.25634	0.46188
4	0.41878	0.25634	0.03812
(1/2,1/2,1/2) + set click here to show and hide
5	0.91878	0.24366	0.03812
6	0.08122	0.24366	0.46188
7	0.08122	0.75634	0.96188
8	0.91878	0.75634	0.53812
(0,0,1/2)' + set click here to show and hide
9	0.41878	0.74366	0.03812
10	0.58122	0.74366	0.46188
11	0.58122	0.25634	0.96188
12	0.41878	0.25634	0.53812
(1/2,1/2,0)' + set click here to show and hide
13	0.91878	0.24366	0.53812
14	0.08122	0.24366	0.96188
15	0.08122	0.75634	0.46188
16	0.91878	0.75634	0.03812

Set of atoms in the unit cell related by symmetry with the atom Al1_4:

Atom	x	y	z
1	0.91878	0.75634	0.21188
2	0.08122	0.75634	0.28812
3	0.08122	0.24366	0.78812
4	0.91878	0.24366	0.71188
(1/2,1/2,1/2) + set click here to show and hide
5	0.41878	0.25634	0.71188
6	0.58122	0.25634	0.78812
7	0.58122	0.74366	0.28812
8	0.41878	0.74366	0.21188
(0,0,1/2)' + set click here to show and hide
9	0.91878	0.75634	0.71188
10	0.08122	0.75634	0.78812
11	0.08122	0.24366	0.28812
12	0.91878	0.24366	0.21188
(1/2,1/2,0)' + set click here to show and hide
13	0.41878	0.25634	0.21188
14	0.58122	0.25634	0.28812
15	0.58122	0.74366	0.78812
16	0.41878	0.74366	0.71188

Set of atoms in the unit cell related by symmetry with the atom Al2_1:

Atom	x	y	z
1	0.78068	0.34203	0.62500
2	0.21932	0.34203	0.87500
3	0.21932	0.65797	0.37500
4	0.78068	0.65797	0.12500
(1/2,1/2,1/2) + set click here to show and hide
5	0.28068	0.84203	0.12500
6	0.71932	0.84203	0.37500
7	0.71932	0.15797	0.87500
8	0.28068	0.15797	0.62500
(0,0,1/2)' + set click here to show and hide
9	0.78068	0.34203	0.12500
10	0.21932	0.34203	0.37500
11	0.21932	0.65797	0.87500
12	0.78068	0.65797	0.62500
(1/2,1/2,0)' + set click here to show and hide
13	0.28068	0.84203	0.62500
14	0.71932	0.84203	0.87500
15	0.71932	0.15797	0.37500
16	0.28068	0.15797	0.12500

Set of atoms in the unit cell related by symmetry with the atom Al2_2:

Atom	x	y	z
1	0.93865	0.50000	0.12500
2	0.06135	0.50000	0.37500
(1/2,1/2,1/2) + set click here to show and hide
3	0.43865	0.00000	0.62500
4	0.56135	0.00000	0.87500
(0,0,1/2)' + set click here to show and hide
5	0.93865	0.50000	0.62500
6	0.06135	0.50000	0.87500
(1/2,1/2,0)' + set click here to show and hide
7	0.43865	0.00000	0.12500
8	0.56135	0.00000	0.37500

Set of atoms in the unit cell related by symmetry with the atom Al3_1:

Atom	x	y	z
1	0.83333	0.50000	0.49240
2	0.16667	0.50000	0.00760
(1/2,1/2,1/2) + set click here to show and hide
3	0.33333	0.00000	0.99240
4	0.66667	0.00000	0.50760
(0,0,1/2)' + set click here to show and hide
5	0.83333	0.50000	0.99240
6	0.16667	0.50000	0.50760
(1/2,1/2,0)' + set click here to show and hide
7	0.33333	0.00000	0.49240
8	0.66667	0.00000	0.00760

Set of atoms in the unit cell related by symmetry with the atom Al3_2:

Atom	x	y	z
1	0.83333	0.50000	0.75760
2	0.16667	0.50000	0.74240
(1/2,1/2,1/2) + set click here to show and hide
3	0.33333	0.00000	0.25760
4	0.66667	0.00000	0.24240
(0,0,1/2)' + set click here to show and hide
5	0.83333	0.50000	0.25760
6	0.16667	0.50000	0.24240
(1/2,1/2,0)' + set click here to show and hide
7	0.33333	0.00000	0.75760
8	0.66667	0.00000	0.74240

Set of atoms in the unit cell related by symmetry with the atom Al4:

Atom	x	y	z
1	0.00000	0.00000	0.12500
2	0.00000	0.00000	0.37500
(1/2,1/2,1/2) + set click here to show and hide
3	0.50000	0.50000	0.62500
4	0.50000	0.50000	0.87500
(0,0,1/2)' + set click here to show and hide
5	0.00000	0.00000	0.62500
6	0.00000	0.00000	0.87500
(1/2,1/2,0)' + set click here to show and hide
7	0.50000	0.50000	0.12500
8	0.50000	0.50000	0.37500

[Hide]

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Dy1_1	Dy	0.09628	0.28884	0.125	16	m_x,m_y,m_z	0.01(5)	-0.18(9)	0.5(2)	0.53
Dy1_2	Dy	0.30744	0.5	0.625	8	m_x,0,m_z	-0.5(2)	0.0	-0.5(2)	0.71

[Show all magnetic atoms in unit cell and their moment relations]

label	dim. full irrep	dim. small irrep	direction	action	number of modes
mL2	6	2	special	primary	5

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

Dy₃Ru₄Al₁₂ (#1.115)

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

Dy3Ru4Al12 (#1.115)

Dy₃Ru₄Al₁₂ (#1.115)