MAGNDATA - Collection of Magnetic Structures

Magnetic atoms:

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	\|M\|
Fe1	Fe	0.19470	0.14970	0.58060	4	m_x,m_y,m_z	3.6(1)	3.60
Fe2	Fe	0.68280	0.03230	0.79210	4	m_x,m_y,m_z	-3.6(1)	3.60
Fe3	Fe	0.80830	0.15920	0.30620	4	m_x,m_y,m_z	-2.5(1)	2.50
Fe4	Fe	0.18160	0.15380	0.00000	4	m_x,m_y,m_z	2.7(3)	2.70

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
O1	O	0.97540	0.32760	0.43400	4
O2	O	0.51120	0.49330	0.41870	4
O3	O	0.65370	0.00110	0.18950	4
O4	O	0.16240	0.16220	0.19560	4
O5	O	0.84490	0.16570	0.66800	4
O6	O	0.52860	0.15900	0.93750	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 Fe1:

Atom	x	y	z	Symmetry constraints on M	M_x
1	0.19470	0.14970	0.58060	m_x,m_y,m_z	3.60000
2	0.30530	0.64970	0.08060	m_x,-m_y,-m_z	3.60000
3	0.80530	0.85030	0.08060	m_x,m_y,-m_z	3.60000
4	0.69470	0.35030	0.58060	m_x,-m_y,m_z	3.60000

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

Atom	x	y	z	Symmetry constraints on M	M_x
1	0.68280	0.03230	0.79210	m_x,m_y,m_z	-3.60000
2	0.81720	0.53230	0.29210	m_x,-m_y,-m_z	-3.60000
3	0.31720	0.96770	0.29210	m_x,m_y,-m_z	-3.60000
4	0.18280	0.46770	0.79210	m_x,-m_y,m_z	-3.60000

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

Atom	x	y	z	Symmetry constraints on M	M_x
1	0.80830	0.15920	0.30620	m_x,m_y,m_z	-2.50000
2	0.69170	0.65920	0.80620	m_x,-m_y,-m_z	-2.50000
3	0.19170	0.84080	0.80620	m_x,m_y,-m_z	-2.50000
4	0.30830	0.34080	0.30620	m_x,-m_y,m_z	-2.50000

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

Atom	x	y	z	Symmetry constraints on M	M_x
1	0.18160	0.15380	0.00000	m_x,m_y,m_z	2.70000
2	0.31840	0.65380	0.50000	m_x,-m_y,-m_z	2.70000
3	0.81840	0.84620	0.50000	m_x,m_y,-m_z	2.70000
4	0.68160	0.34620	0.00000	m_x,-m_y,m_z	2.70000

Non-magnetic atoms:

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

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

Set of atoms in the unit cell related by symmetry with the atom O3:

Set of atoms in the unit cell related by symmetry with the atom O4:

Set of atoms in the unit cell related by symmetry with the atom O5:

Set of atoms in the unit cell related by symmetry with the atom O6:

[Hide]

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	\|M\|
Fe1	Fe	0.19470	0.14970	0.58060	4	m_x,m_y,m_z	3.6(1)	3.60
Fe2	Fe	0.68280	0.03230	0.79210	4	m_x,m_y,m_z	-3.6(1)	3.60
Fe3	Fe	0.80830	0.15920	0.30620	4	m_x,m_y,m_z	-2.5(1)	2.50
Fe4	Fe	0.18160	0.15380	0.00000	4	m_x,m_y,m_z	2.7(3)	2.70

label	dim. small irrep	dim. full irrep	action	number of modes
mGM3+	1	1	primary	12

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