MAGNDATA - Collection of Magnetic Structures

Magnetic atoms:

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	\|M\|
Fe1	Fe	0.19280	0.14990	0.58130	4	m_x,m_y,m_z	3.1(1)	3.10
Fe2	Fe	0.68230	0.03140	0.79180	4	m_x,m_y,m_z	-3.1(1)	3.10
Fe3	Fe	0.81050	0.15830	0.30790	4	m_x,m_y,m_z	-0.9(2)	0.90
Fe4	Fe	0.18190	0.15420	0.00000	4	m_x,m_y,m_z	0.9(3)	0.90

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
O1	O	0.97390	0.32810	0.43450	4
O2	O	0.50300	0.49070	0.42270	4
O3	O	0.65330	0.99900	0.18590	4
O4	O	0.16140	0.16080	0.19590	4
O5	O	0.84500	0.16690	0.66980	4
O6	O	0.53860	0.16540	0.93660	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	0.19280	0.14990	0.58130	m_x,m_y,m_z	3.10000
2	0.30720	0.64990	0.08130	m_x,-m_y,-m_z	3.10000
3	0.80720	0.85010	0.08130	m_x,m_y,-m_z	3.10000
4	0.69280	0.35010	0.58130	m_x,-m_y,m_z	3.10000

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	0.68230	0.03140	0.79180	m_x,m_y,m_z	-3.10000
2	0.81770	0.53140	0.29180	m_x,-m_y,-m_z	-3.10000
3	0.31770	0.96860	0.29180	m_x,m_y,-m_z	-3.10000
4	0.18230	0.46860	0.79180	m_x,-m_y,m_z	-3.10000

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	0.81050	0.15830	0.30790	m_x,m_y,m_z	-0.90000
2	0.68950	0.65830	0.80790	m_x,-m_y,-m_z	-0.90000
3	0.18950	0.84170	0.80790	m_x,m_y,-m_z	-0.90000
4	0.31050	0.34170	0.30790	m_x,-m_y,m_z	-0.90000

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	0.18190	0.15420	0.00000	m_x,m_y,m_z	0.90000
2	0.31810	0.65420	0.50000	m_x,-m_y,-m_z	0.90000
3	0.81810	0.84580	0.50000	m_x,m_y,-m_z	0.90000
4	0.68190	0.34580	0.00000	m_x,-m_y,m_z	0.90000

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:

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Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	\|M\|
Fe1	Fe	0.19280	0.14990	0.58130	4	m_x,m_y,m_z	3.1(1)	3.10
Fe2	Fe	0.68230	0.03140	0.79180	4	m_x,m_y,m_z	-3.1(1)	3.10
Fe3	Fe	0.81050	0.15830	0.30790	4	m_x,m_y,m_z	-0.9(2)	0.90
Fe4	Fe	0.18190	0.15420	0.00000	4	m_x,m_y,m_z	0.9(3)	0.90

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