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	{ -1 \| 0 }
3	-x,y,-z,-1	{ 2'₀₁₀ \| 0 }
4	x,-y,z,-1	{ m'₀₁₀ \| 0 }
(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+1/2,+1	{ -1 \| 1/2 1/2 1/2 }
7	-x+1/2,y+1/2,-z+1/2,-1	{ 2'₀₁₀ \| 1/2 1/2 1/2 }
8	x+1/2,-y+1/2,z+1/2,-1	{ m'₀₁₀ \| 1/2 1/2 1/2 }

[Hide]

Magnetic atoms:

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Co1_1	Co	0.00000	0.00000	0.00000	2	m_x,0,m_z	0.0	0.0	4.4(1)	4.40
Co1_2	Co	0.00000	0.00000	0.33333	4	m_x,0,m_z	0.0	0.0	-4.4(1)	4.40

Non-magnetic atoms:

Label	Atom type	x	z	Multiplicity
V1_1	V	0.19100	0.84467	4
V1_2	V	0.19100	0.17800	4
V1_3	V	0.80900	0.48867	4
O1_1	O	0.34640	0.81897	4
O1_2	O	0.34640	0.15230	4
O1_3	O	0.65360	0.51437	4
O2_1	O	0.03330	0.77040	4
O2_2	O	0.03330	0.10373	4
O2_3	O	0.96670	0.56293	4
O3_1	O	0.30880	0.95693	4
O3_2	O	0.30880	0.29027	4
O3_3	O	0.69120	0.37640	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_1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.00000	0.00000	m_x,0,m_z	0.00000	0.00000	4.40000
(1/2,1/2,1/2) + set click here to show and hide
2	0.50000	0.50000	0.50000	m_x,0,m_z	0.00000	0.00000	4.40000

Set of atoms in the unit cell related by symmetry with the magnetic atom Co1_2:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.00000	0.33333	m_x,0,m_z	0.00000	0.00000	-4.40000
2	0.00000	0.00000	0.66667	m_x,0,m_z	0.00000	0.00000	-4.40000
(1/2,1/2,1/2) + set click here to show and hide
3	0.50000	0.50000	0.83333	m_x,0,m_z	0.00000	0.00000	-4.40000
4	0.50000	0.50000	0.16667	m_x,0,m_z	0.00000	0.00000	-4.40000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom V1_1:

Atom	x	y	z
1	0.19100	0.00000	0.84467
2	0.80900	0.00000	0.15533
(1/2,1/2,1/2) + set click here to show and hide
3	0.69100	0.50000	0.34467
4	0.30900	0.50000	0.65533

Set of atoms in the unit cell related by symmetry with the atom V1_2:

Atom	x	y	z
1	0.19100	0.00000	0.17800
2	0.80900	0.00000	0.82200
(1/2,1/2,1/2) + set click here to show and hide
3	0.69100	0.50000	0.67800
4	0.30900	0.50000	0.32200

Set of atoms in the unit cell related by symmetry with the atom V1_3:

Atom	x	y	z
1	0.80900	0.00000	0.48867
2	0.19100	0.00000	0.51133
(1/2,1/2,1/2) + set click here to show and hide
3	0.30900	0.50000	0.98867
4	0.69100	0.50000	0.01133

Set of atoms in the unit cell related by symmetry with the atom O1_1:

Atom	x	y	z
1	0.34640	0.00000	0.81897
2	0.65360	0.00000	0.18103
(1/2,1/2,1/2) + set click here to show and hide
3	0.84640	0.50000	0.31897
4	0.15360	0.50000	0.68103

Set of atoms in the unit cell related by symmetry with the atom O1_2:

Atom	x	y	z
1	0.34640	0.00000	0.15230
2	0.65360	0.00000	0.84770
(1/2,1/2,1/2) + set click here to show and hide
3	0.84640	0.50000	0.65230
4	0.15360	0.50000	0.34770

Set of atoms in the unit cell related by symmetry with the atom O1_3:

Atom	x	y	z
1	0.65360	0.00000	0.51437
2	0.34640	0.00000	0.48563
(1/2,1/2,1/2) + set click here to show and hide
3	0.15360	0.50000	0.01437
4	0.84640	0.50000	0.98563

Set of atoms in the unit cell related by symmetry with the atom O2_1:

Atom	x	y	z
1	0.03330	0.00000	0.77040
2	0.96670	0.00000	0.22960
(1/2,1/2,1/2) + set click here to show and hide
3	0.53330	0.50000	0.27040
4	0.46670	0.50000	0.72960

Set of atoms in the unit cell related by symmetry with the atom O2_2:

Atom	x	y	z
1	0.03330	0.00000	0.10373
2	0.96670	0.00000	0.89627
(1/2,1/2,1/2) + set click here to show and hide
3	0.53330	0.50000	0.60373
4	0.46670	0.50000	0.39627

Set of atoms in the unit cell related by symmetry with the atom O2_3:

Atom	x	y	z
1	0.96670	0.00000	0.56293
2	0.03330	0.00000	0.43707
(1/2,1/2,1/2) + set click here to show and hide
3	0.46670	0.50000	0.06293
4	0.53330	0.50000	0.93707

Set of atoms in the unit cell related by symmetry with the atom O3_1:

Atom	x	y	z
1	0.30880	0.00000	0.95693
2	0.69120	0.00000	0.04307
(1/2,1/2,1/2) + set click here to show and hide
3	0.80880	0.50000	0.45693
4	0.19120	0.50000	0.54307

Set of atoms in the unit cell related by symmetry with the atom O3_2:

Atom	x	y	z
1	0.30880	0.00000	0.29027
2	0.69120	0.00000	0.70973
(1/2,1/2,1/2) + set click here to show and hide
3	0.80880	0.50000	0.79027
4	0.19120	0.50000	0.20973

Set of atoms in the unit cell related by symmetry with the atom O3_3:

Atom	x	y	z
1	0.69120	0.00000	0.37640
2	0.30880	0.00000	0.62360
(1/2,1/2,1/2) + set click here to show and hide
3	0.19120	0.50000	0.87640
4	0.80880	0.50000	0.12360

[Hide]

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Co1_1	Co	0.00000	0.00000	0.00000	2	m_x,0,m_z	0.0	0.0	4.4(1)	4.40
Co1_2	Co	0.00000	0.00000	0.33333	4	m_x,0,m_z	0.0	0.0	-4.4(1)	4.40

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