MAGNDATA - Collection of Magnetic Structures

N	(x,y,z)	Seitz notation
1	x,y,z,+1	{ 1 \| 0 }
2	-x,y,z,-1	{ m'₁₀₀ \| 0 }
3	x,-y,z+1/2,-1	{ m'₀₁₀ \| 0 0 1/2 }
4	-x,-y,z+1/2,+1	{ 2₀₀₁ \| 0 0 1/2 }
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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	{ m'₁₀₀ \| 1/2 1/2 0 }
7	x+1/2,-y+1/2,z+1/2,-1	{ m'₀₁₀ \| 1/2 1/2 1/2 }
8	-x+1/2,-y+1/2,z+1/2,+1	{ 2₀₀₁ \| 1/2 1/2 1/2 }

N	(x,y,z)	Seitz notation
1	x,y,z,+1	1
2	-x,y,z,-1	m'₁₀₀
3	x,-y,z,-1	m'₀₁₀
4	-x,-y,z,+1	2₀₀₁

Magnetic atoms:

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_z	\|M\|
Mn1	Mn	0.14321	0.34476	0.38100	8	m_x,m_y,m_z	-1.8(2)	1.80
Mn2	Mn	0.00000	0.45404	0.67837	4	0,m_y,m_z	2.42(9)	2.42
Mn3	Mn	0.00000	0.13795	0.18673	4	0,m_y,m_z	1.72(8)	1.72
Mn4	Mn	0.12578	0.00394	0.43734	8	m_x,m_y,m_z	-0.51(6)	0.51
Mn5	Mn	0.12150	0.17804	0.69239	8	m_x,m_y,m_z	-0.50(4)	0.50
Mn6	Mn	0.15065	0.33239	0.00000	8	m_x,m_y,m_z	-1.7(2)	1.70

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
Si1	Si	0.25118	0.07808	0.19022	8
C1	C	0.00000	0.19523	0.47950	4
C2	C	0.00000	0.18949	0.90593	4

[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 Mn1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.14321	0.34476	0.38100	m_x,m_y,m_z	0.00000	0.00000	-1.80000
2	0.85679	0.34476	0.38100	-m_x,m_y,m_z	0.00000	0.00000	-1.80000
3	0.14321	0.65524	0.88100	m_x,-m_y,m_z	0.00000	0.00000	-1.80000
4	0.85679	0.65524	0.88100	-m_x,-m_y,m_z	0.00000	0.00000	-1.80000
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5	0.64321	0.84476	0.38100	m_x,m_y,m_z	0.00000	0.00000	-1.80000
6	0.35679	0.84476	0.38100	-m_x,m_y,m_z	0.00000	0.00000	-1.80000
7	0.64321	0.15524	0.88100	m_x,-m_y,m_z	0.00000	0.00000	-1.80000
8	0.35679	0.15524	0.88100	-m_x,-m_y,m_z	0.00000	0.00000	-1.80000

Set of atoms in the unit cell related by symmetry with the magnetic atom Mn2:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.45404	0.67837	0,m_y,m_z	0.00000	0.00000	2.42000
2	0.00000	0.54596	0.17837	0,-m_y,m_z	0.00000	0.00000	2.42000
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3	0.50000	0.95404	0.67837	0,m_y,m_z	0.00000	0.00000	2.42000
4	0.50000	0.04596	0.17837	0,-m_y,m_z	0.00000	0.00000	2.42000

Set of atoms in the unit cell related by symmetry with the magnetic atom Mn3:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.13795	0.18673	0,m_y,m_z	0.00000	0.00000	1.72000
2	0.00000	0.86205	0.68673	0,-m_y,m_z	0.00000	0.00000	1.72000
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3	0.50000	0.63795	0.18673	0,m_y,m_z	0.00000	0.00000	1.72000
4	0.50000	0.36205	0.68673	0,-m_y,m_z	0.00000	0.00000	1.72000

Set of atoms in the unit cell related by symmetry with the magnetic atom Mn4:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.12578	0.00394	0.43734	m_x,m_y,m_z	0.00000	0.00000	-0.51000
2	0.87422	0.00394	0.43734	-m_x,m_y,m_z	0.00000	0.00000	-0.51000
3	0.12578	0.99606	0.93734	m_x,-m_y,m_z	0.00000	0.00000	-0.51000
4	0.87422	0.99606	0.93734	-m_x,-m_y,m_z	0.00000	0.00000	-0.51000
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5	0.62578	0.50394	0.43734	m_x,m_y,m_z	0.00000	0.00000	-0.51000
6	0.37422	0.50394	0.43734	-m_x,m_y,m_z	0.00000	0.00000	-0.51000
7	0.62578	0.49606	0.93734	m_x,-m_y,m_z	0.00000	0.00000	-0.51000
8	0.37422	0.49606	0.93734	-m_x,-m_y,m_z	0.00000	0.00000	-0.51000

Set of atoms in the unit cell related by symmetry with the magnetic atom Mn5:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.12150	0.17804	0.69239	m_x,m_y,m_z	0.00000	0.00000	-0.50000
2	0.87850	0.17804	0.69239	-m_x,m_y,m_z	0.00000	0.00000	-0.50000
3	0.12150	0.82196	0.19239	m_x,-m_y,m_z	0.00000	0.00000	-0.50000
4	0.87850	0.82196	0.19239	-m_x,-m_y,m_z	0.00000	0.00000	-0.50000
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5	0.62150	0.67804	0.69239	m_x,m_y,m_z	0.00000	0.00000	-0.50000
6	0.37850	0.67804	0.69239	-m_x,m_y,m_z	0.00000	0.00000	-0.50000
7	0.62150	0.32196	0.19239	m_x,-m_y,m_z	0.00000	0.00000	-0.50000
8	0.37850	0.32196	0.19239	-m_x,-m_y,m_z	0.00000	0.00000	-0.50000

Set of atoms in the unit cell related by symmetry with the magnetic atom Mn6:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.15065	0.33239	0.00000	m_x,m_y,m_z	0.00000	0.00000	-1.70000
2	0.84935	0.33239	0.00000	-m_x,m_y,m_z	0.00000	0.00000	-1.70000
3	0.15065	0.66761	0.50000	m_x,-m_y,m_z	0.00000	0.00000	-1.70000
4	0.84935	0.66761	0.50000	-m_x,-m_y,m_z	0.00000	0.00000	-1.70000
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5	0.65065	0.83239	0.00000	m_x,m_y,m_z	0.00000	0.00000	-1.70000
6	0.34935	0.83239	0.00000	-m_x,m_y,m_z	0.00000	0.00000	-1.70000
7	0.65065	0.16761	0.50000	m_x,-m_y,m_z	0.00000	0.00000	-1.70000
8	0.34935	0.16761	0.50000	-m_x,-m_y,m_z	0.00000	0.00000	-1.70000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom Si1:

Atom	x	y	z
1	0.25118	0.07808	0.19022
2	0.74882	0.07808	0.19022
3	0.25118	0.92192	0.69022
4	0.74882	0.92192	0.69022
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5	0.75118	0.57808	0.19022
6	0.24882	0.57808	0.19022
7	0.75118	0.42192	0.69022
8	0.24882	0.42192	0.69022

Set of atoms in the unit cell related by symmetry with the atom C1:

Atom	x	y	z
1	0.00000	0.19523	0.47950
2	0.00000	0.80477	0.97950
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3	0.50000	0.69523	0.47950
4	0.50000	0.30477	0.97950

Set of atoms in the unit cell related by symmetry with the atom C2:

Atom	x	y	z
1	0.00000	0.18949	0.90593
2	0.00000	0.81051	0.40593
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3	0.50000	0.68949	0.90593
4	0.50000	0.31051	0.40593

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Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_z	\|M\|
Mn1	Mn	0.14321	0.34476	0.38100	8	m_x,m_y,m_z	-1.8(2)	1.80
Mn2	Mn	0.00000	0.45404	0.67837	4	0,m_y,m_z	2.42(9)	2.42
Mn3	Mn	0.00000	0.13795	0.18673	4	0,m_y,m_z	1.72(8)	1.72
Mn4	Mn	0.12578	0.00394	0.43734	8	m_x,m_y,m_z	-0.51(6)	0.51
Mn5	Mn	0.12150	0.17804	0.69239	8	m_x,m_y,m_z	-0.50(4)	0.50
Mn6	Mn	0.15065	0.33239	0.00000	8	m_x,m_y,m_z	-1.7(2)	1.70

[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: