MAGNDATA - Collection of Magnetic Structures

Transformation matrix from the setting of the parent structure (a_p,b_p,c_p) to the working setting (a,b,c):

[Hide]

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+1/2,-z,+1	{ 2₀₁₀ \| 1/2 1/2 0 }
3	-x+1/2,-y+1/2,-z,+1	{ -1 \| 1/2 1/2 0 }
4	x,-y,z,+1	{ m₀₁₀ \| 0 }
(1/2,1/2,0)' + set click here to show and hide
5	x+1/2,y+1/2,z,-1	{ 1' \| 1/2 1/2 0 }
6	-x,y,-z,-1	{ 2'₀₁₀ \| 0 }
7	-x,-y,-z,-1	{ -1' \| 0 }
8	x+1/2,-y+1/2,z,-1	{ m'₀₁₀ \| 1/2 1/2 0 }

[Hide]

Transformation matrix from the working setting (a,b,c) to the standard setting of the magnetic space group (a_s,b_s,c_s):

[Hide]

Symmetry operations of the magnetic point group in the setting used:

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

[Hide]

Magnetic atoms:

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Co1	Co	0.00000	0.21032	0.50000	4	m_x,0,m_z	3.26(5)	0.0	1.90(22)	2.98

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
O1	O	0.24020	0.30017	0.71130	8
O2	O	0.20570	0.13417	0.84330	8
C1	C	0.21320	0.35980	0.85430	8
C2	C	0.09100	0.42998	0.66030	8
C3	C	0.67550	0.00000	0.81380	4
H3	H	0.79370	0.00000	0.02840	4

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 Co1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.21032	0.50000	m_x,0,m_z	3.26000	0.00000	1.90000
2	0.50000	0.28968	0.50000	m_x,0,m_z	3.26000	0.00000	1.90000
(1/2,1/2,0)' + set click here to show and hide
3	0.50000	0.71032	0.50000	-m_x,0,-m_z	-3.26000	0.00000	-1.90000
4	0.00000	0.78968	0.50000	-m_x,0,-m_z	-3.26000	0.00000	-1.90000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom O1:

Atom	x	y	z
1	0.24020	0.30017	0.71130
2	0.25980	0.80017	0.28870
3	0.25980	0.19983	0.28870
4	0.24020	0.69983	0.71130
(1/2,1/2,0)' + set click here to show and hide
5	0.74020	0.80017	0.71130
6	0.75980	0.30017	0.28870
7	0.75980	0.69983	0.28870
8	0.74020	0.19983	0.71130

Set of atoms in the unit cell related by symmetry with the atom O2:

Atom	x	y	z
1	0.20570	0.13417	0.84330
2	0.29430	0.63417	0.15670
3	0.29430	0.36583	0.15670
4	0.20570	0.86583	0.84330
(1/2,1/2,0)' + set click here to show and hide
5	0.70570	0.63417	0.84330
6	0.79430	0.13417	0.15670
7	0.79430	0.86583	0.15670
8	0.70570	0.36583	0.84330

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

Atom	x	y	z
1	0.21320	0.35980	0.85430
2	0.28680	0.85980	0.14570
3	0.28680	0.14020	0.14570
4	0.21320	0.64020	0.85430
(1/2,1/2,0)' + set click here to show and hide
5	0.71320	0.85980	0.85430
6	0.78680	0.35980	0.14570
7	0.78680	0.64020	0.14570
8	0.71320	0.14020	0.85430

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

Atom	x	y	z
1	0.09100	0.42998	0.66030
2	0.40900	0.92998	0.33970
3	0.40900	0.07002	0.33970
4	0.09100	0.57002	0.66030
(1/2,1/2,0)' + set click here to show and hide
5	0.59100	0.92998	0.66030
6	0.90900	0.42998	0.33970
7	0.90900	0.57002	0.33970
8	0.59100	0.07002	0.66030

Set of atoms in the unit cell related by symmetry with the atom C3:

Atom	x	y	z
1	0.67550	0.00000	0.81380
2	0.82450	0.50000	0.18620
(1/2,1/2,0)' + set click here to show and hide
3	0.17550	0.50000	0.81380
4	0.32450	0.00000	0.18620

Set of atoms in the unit cell related by symmetry with the atom H3:

Atom	x	y	z
1	0.79370	0.00000	0.02840
2	0.70630	0.50000	0.97160
(1/2,1/2,0)' + set click here to show and hide
3	0.29370	0.50000	0.02840
4	0.20630	0.00000	0.97160

[Hide]

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Co1	Co	0.00000	0.21032	0.50000	4	m_x,0,m_z	3.26(5)	0.0	1.90(22)	2.98

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