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

[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	0.00000	0.00000	4	m_x,m_y,m_z	-3.94(2)	0.0	-2.10(5)	3.62

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
Li1	Li	0.25000	0.00000	0.50000	4
F1	F	0.42660	0.79240	0.66680	8
F2	F	0.16245	0.68440	0.62390	8

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.00000	0.00000	m_x,m_y,m_z	-3.94000	0.00000	-2.10000
2	0.00000	0.50000	0.50000	-m_x,m_y,-m_z	3.94000	0.00000	2.10000
(1/2,0,0)' + set click here to show and hide
3	0.50000	0.00000	0.00000	-m_x,-m_y,-m_z	3.94000	0.00000	2.10000
4	0.50000	0.50000	0.50000	m_x,-m_y,m_z	-3.94000	0.00000	-2.10000

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

Atom	x	y	z
1	0.42660	0.79240	0.66680
2	0.57340	0.29240	0.83320
3	0.57340	0.20760	0.33320
4	0.42660	0.70760	0.16680
(1/2,0,0)' + set click here to show and hide
5	0.92660	0.79240	0.66680
6	0.07340	0.29240	0.83320
7	0.07340	0.20760	0.33320
8	0.92660	0.70760	0.16680

Atom	x	y	z
1	0.16245	0.68440	0.62390
2	0.83755	0.18440	0.87610
3	0.83755	0.31560	0.37610
4	0.16245	0.81560	0.12390
(1/2,0,0)' + set click here to show and hide
5	0.66245	0.68440	0.62390
6	0.33755	0.18440	0.87610
7	0.33755	0.31560	0.37610
8	0.66245	0.81560	0.12390

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Co1	Co	0.00000	0.00000	0.00000	4	m_x,m_y,m_z	-3.94(2)	0.0	-2.10(5)	3.62

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.00000	0.00000	m_x,m_y,m_z	-3.94000	0.00000	-2.10000
2	0.00000	0.50000	0.50000	-m_x,m_y,-m_z	3.94000	0.00000	2.10000
(1/2,0,0)' + set click here to show and hide
3	0.50000	0.00000	0.00000	-m_x,-m_y,-m_z	3.94000	0.00000	2.10000
4	0.50000	0.50000	0.50000	m_x,-m_y,m_z	-3.94000	0.00000	-2.10000

label	dim. small irrep	dim. full irrep	action	number of modes
mY1+	1	1	primary	3

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