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,x,z+1/2,+1	{ 6⁺₀₀₁ \| 0 0 1/2 }
3	-y,x-y,z,+1	{ 3⁺₀₀₁ \| 0 }
4	-x,-y,z+1/2,+1	{ 2₀₀₁ \| 0 0 1/2 }
5	-x+y,-x,z,+1	{ 3^-₀₀₁ \| 0 }
6	y,-x+y,z+1/2,+1	{ 6^-₀₀₁ \| 0 0 1/2 }
7	-x,-y,-z,+1	{ -1 \| 0 }
8	-x+y,-x,-z+1/2,+1	{ -6⁺₀₀₁ \| 0 0 1/2 }
9	y,-x+y,-z,+1	{ -3⁺₀₀₁ \| 0 }
10	x,y,-z+1/2,+1	{ m₀₀₁ \| 0 0 1/2 }
11	x-y,x,-z,+1	{ -3^-₀₀₁ \| 0 }
12	-y,x-y,-z+1/2,+1	{ -6^-₀₀₁ \| 0 0 1/2 }
13	x-y,-y,-z,-1	{ 2'₁₀₀ \| 0 }
14	y,x,-z,-1	{ 2'₁₁₀ \| 0 }
15	-x,-x+y,-z,-1	{ 2'₀₁₀ \| 0 }
16	x,x-y,-z+1/2,-1	{ 2'₂₁₀ \| 0 0 1/2 }
17	-x+y,y,-z+1/2,-1	{ 2'₁₂₀ \| 0 0 1/2 }
18	-y,-x,-z+1/2,-1	{ 2'_1-10 \| 0 0 1/2 }
19	-x+y,y,z,-1	{ m'₁₀₀ \| 0 }
20	-y,-x,z,-1	{ m'₁₁₀ \| 0 }
21	x,x-y,z,-1	{ m'₀₁₀ \| 0 }
22	-x,-x+y,z+1/2,-1	{ m'₂₁₀ \| 0 0 1/2 }
23	x-y,-y,z+1/2,-1	{ m'₁₂₀ \| 0 0 1/2 }
24	y,x,z+1/2,-1	{ m'_1-10 \| 0 0 1/2 }

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N	(x,y,z)	Seitz notation
1	x,y,z,+1	1
2	x-y,x,z,+1	6⁺₀₀₁
3	-y,x-y,z,+1	3⁺₀₀₁
4	-x,-y,z,+1	2₀₀₁
5	-x+y,-x,z,+1	3^-₀₀₁
6	y,-x+y,z,+1	6^-₀₀₁
7	-x,-y,-z,+1	-1
8	-x+y,-x,-z,+1	-6⁺₀₀₁
9	y,-x+y,-z,+1	-3⁺₀₀₁
10	x,y,-z,+1	m₀₀₁
11	x-y,x,-z,+1	-3^-₀₀₁
12	-y,x-y,-z,+1	-6^-₀₀₁
13	x-y,-y,-z,-1	2'₁₀₀
14	y,x,-z,-1	2'₁₁₀
15	-x,-x+y,-z,-1	2'₀₁₀
16	x,x-y,-z,-1	2'₂₁₀
17	-x+y,y,-z,-1	2'₁₂₀
18	-y,-x,-z,-1	2'_1-10
19	-x+y,y,z,-1	m'₁₀₀
20	-y,-x,z,-1	m'₁₁₀
21	x,x-y,z,-1	m'₀₁₀
22	-x,-x+y,z,-1	m'₂₁₀
23	x-y,-y,z,-1	m'₁₂₀
24	y,x,z,-1	m'_1-10

Magnetic atoms:

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_z	\|M\|
Fe1	Fe	0.33333	0.66667	0.10900	4	0,0,m_z	-2.2(1)	2.20
Fe2	Fe	0.50000	0.00000	0.00000	6	m_x,2m_x,m_z	-2.2(1)	2.20
Fe3	Fe	0.32300	0.96300	0.25000	12	0,0,m_z	-2.2(1)	2.20
Fe4	Fe	0.16400	0.32800	0.98700	12	m_x,2m_x,m_z	-2.2(1)	2.20
Tm1	Tm	0.00000	0.00000	0.25000	2	0,0,m_z	6.4(2)	6.40
Tm2	Tm	0.33333	0.66667	0.75000	2	0,0,m_z	6.4(2)	6.40

[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 Fe1:

Atom	x	y	z	Symmetry constraints on M	M_z
1	0.33333	0.66667	0.10900	0,0,m_z	-2.20000
2	0.66666	0.33333	0.60900	0,0,m_z	-2.20000
3	0.66667	0.33333	0.89100	0,0,m_z	-2.20000
4	0.33334	0.66667	0.39100	0,0,m_z	-2.20000

Set of atoms in the unit cell related by symmetry with the magnetic atom Fe2:

Atom	x	y	z	Symmetry constraints on M	M_z
1	0.50000	0.00000	0.00000	m_x,2m_x,m_z	-2.20000
2	0.50000	0.50000	0.50000	-m_x,m_x,m_z	-2.20000
3	0.00000	0.50000	0.00000	-2m_x,-m_x,m_z	-2.20000
4	0.50000	0.00000	0.50000	-m_x,-2m_x,m_z	-2.20000
5	0.50000	0.50000	0.00000	m_x,-m_x,m_z	-2.20000
6	0.00000	0.50000	0.50000	2m_x,m_x,m_z	-2.20000

Set of atoms in the unit cell related by symmetry with the magnetic atom Fe3:

Atom	x	y	z	Symmetry constraints on M	M_z
1	0.32300	0.96300	0.25000	0,0,m_z	-2.20000
2	0.36000	0.32300	0.75000	0,0,m_z	-2.20000
3	0.03700	0.36000	0.25000	0,0,m_z	-2.20000
4	0.67700	0.03700	0.75000	0,0,m_z	-2.20000
5	0.64000	0.67700	0.25000	0,0,m_z	-2.20000
6	0.96300	0.64000	0.75000	0,0,m_z	-2.20000
7	0.36000	0.03700	0.75000	0,0,m_z	-2.20000
8	0.96300	0.32300	0.75000	0,0,m_z	-2.20000
9	0.67700	0.64000	0.75000	0,0,m_z	-2.20000
10	0.32300	0.36000	0.25000	0,0,m_z	-2.20000
11	0.64000	0.96300	0.25000	0,0,m_z	-2.20000
12	0.03700	0.67700	0.25000	0,0,m_z	-2.20000

Set of atoms in the unit cell related by symmetry with the magnetic atom Fe4:

Atom	x	y	z	Symmetry constraints on M	M_z
1	0.16400	0.32800	0.98700	m_x,2m_x,m_z	-2.20000
2	0.83600	0.16400	0.48700	-m_x,m_x,m_z	-2.20000
3	0.67200	0.83600	0.98700	-2m_x,-m_x,m_z	-2.20000
4	0.83600	0.67200	0.48700	-m_x,-2m_x,m_z	-2.20000
5	0.16400	0.83600	0.98700	m_x,-m_x,m_z	-2.20000
6	0.32800	0.16400	0.48700	2m_x,m_x,m_z	-2.20000
7	0.83600	0.67200	0.01300	m_x,2m_x,m_z	-2.20000
8	0.16400	0.83600	0.51300	-m_x,m_x,m_z	-2.20000
9	0.32800	0.16400	0.01300	-2m_x,-m_x,m_z	-2.20000
10	0.16400	0.32800	0.51300	-m_x,-2m_x,m_z	-2.20000
11	0.83600	0.16400	0.01300	m_x,-m_x,m_z	-2.20000
12	0.67200	0.83600	0.51300	2m_x,m_x,m_z	-2.20000

Set of atoms in the unit cell related by symmetry with the magnetic atom Tm1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.00000	0.25000	0,0,m_z	0.00000	0.00000	6.40000
2	0.00000	0.00000	0.75000	0,0,m_z	0.00000	0.00000	6.40000

Set of atoms in the unit cell related by symmetry with the magnetic atom Tm2:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.33333	0.66667	0.75000	0,0,m_z	0.00000	0.00000	6.40000
2	0.66666	0.33333	0.25000	0,0,m_z	0.00000	0.00000	6.40000

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Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_z	\|M\|
Fe1	Fe	0.33333	0.66667	0.10900	4	0,0,m_z	-2.2(1)	2.20
Fe2	Fe	0.50000	0.00000	0.00000	6	m_x,2m_x,m_z	-2.2(1)	2.20
Fe3	Fe	0.32300	0.96300	0.25000	12	0,0,m_z	-2.2(1)	2.20
Fe4	Fe	0.16400	0.32800	0.98700	12	m_x,2m_x,m_z	-2.2(1)	2.20
Tm1	Tm	0.00000	0.00000	0.25000	2	0,0,m_z	6.4(2)	6.40
Tm2	Tm	0.33333	0.66667	0.75000	2	0,0,m_z	6.4(2)	6.40

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

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