MAGNDATA - Collection of Magnetic Structures

Magnetic atoms:

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_z	\|M\|
Tm1	Tm	0.25000	0.25000	0.78440	2	0,0,m_z	0.0	0.00
Tm2	Tm	0.25000	0.25000	0.28590	2	0,0,m_z	0.0	0.00
Mn1	Mn	0.25000	0.75000	0.27730	2	0,0,m_z	1.957(9)	1.96
Mn2	Mn	0.25000	0.75000	0.76250	2	0,0,m_z	-3.10(1)	3.10
Mn3	Mn	0.00000	0.00000	0.00000	4	m_x,m_y,m_z	1.89(1)	1.89
Mn4	Mn	0.00000	0.00000	0.50000	4	m_x,m_y,m_z	1.58(1)	1.58

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
O1	O	0.43550	-0.0681	0.26710	8
O2	O	0.05820	0.25000	0.04510	4
O3	O	0.25000	0.52810	0.92020	4
O4	O	0.54030	0.25000	0.41770	4
O5	O	0.25000	0.43070	0.54080	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 Tm1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.25000	0.25000	0.78440	0,0,m_z	0.00000	0.00000	0.00000
2	0.75000	0.75000	0.21560	0,0,m_z	0.00000	0.00000	0.00000

Set of atoms in the unit cell related by symmetry with the magnetic atom Tm2:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.25000	0.25000	0.28590	0,0,m_z	0.00000	0.00000	0.00000
2	0.75000	0.75000	0.71410	0,0,m_z	0.00000	0.00000	0.00000

Set of atoms in the unit cell related by symmetry with the magnetic atom Mn1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.25000	0.75000	0.27730	0,0,m_z	0.00000	0.00000	1.95700
2	0.75000	0.25000	0.72270	0,0,m_z	0.00000	0.00000	1.95700

Set of atoms in the unit cell related by symmetry with the magnetic atom Mn2:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.25000	0.75000	0.76250	0,0,m_z	0.00000	0.00000	-3.10000
2	0.75000	0.25000	0.23750	0,0,m_z	0.00000	0.00000	-3.10000

Set of atoms in the unit cell related by symmetry with the magnetic atom Mn3:

Atom	x	y	Symmetry constraints on M	M_z
1	0.00000	0.00000	m_x,m_y,m_z	1.89000
2	0.50000	0.50000	-m_x,-m_y,m_z	1.89000
3	0.50000	0.00000	-m_x,m_y,m_z	1.89000
4	0.00000	0.50000	m_x,-m_y,m_z	1.89000

Set of atoms in the unit cell related by symmetry with the magnetic atom Mn4:

Atom	x	y	z	Symmetry constraints on M	M_z
1	0.00000	0.00000	0.50000	m_x,m_y,m_z	1.58000
2	0.50000	0.50000	0.50000	-m_x,-m_y,m_z	1.58000
3	0.50000	0.00000	0.50000	-m_x,m_y,m_z	1.58000
4	0.00000	0.50000	0.50000	m_x,-m_y,m_z	1.58000

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:

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Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_z	\|M\|
Tm1	Tm	0.25000	0.25000	0.78440	2	0,0,m_z	0.0	0.00
Tm2	Tm	0.25000	0.25000	0.28590	2	0,0,m_z	0.0	0.00
Mn1	Mn	0.25000	0.75000	0.27730	2	0,0,m_z	1.957(9)	1.96
Mn2	Mn	0.25000	0.75000	0.76250	2	0,0,m_z	-3.10(1)	3.10
Mn3	Mn	0.00000	0.00000	0.00000	4	m_x,m_y,m_z	1.89(1)	1.89
Mn4	Mn	0.00000	0.00000	0.50000	4	m_x,m_y,m_z	1.58(1)	1.58

label	dim. small irrep	dim. full irrep	action	number of modes
mGM2+	1	1	primary	10

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