MAGNDATA - Collection of Magnetic Structures

Symmetry operations of the magnetic space group in the setting used:

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Magnetic atoms:

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_z	\|M\|
Mn1	Mn	0.25000	0.25000	0.25000	2	0,0,m_z	5.1(1)	5.10
Mn2	Mn	0.25000	0.25000	0.75000	2	0,0,m_z	5.1	5.10
Pr1	Pr	0.75000	0.25000	0.22320	4	0,0,m_z	-2.2(1)	2.20
Mn3	Mn	0.00000	0.00000	0.00000	4	m_x,m_y,m_z	-5.1	5.10

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
Sb1	Sb	0.00000	0.00000	0.50000	4
O1	O	0.95300	0.56300	0.22800	8
O2	O	0.77400	0.96400	0.58000	8
O3	O	0.73600	0.07200	0.97000	8

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 Mn1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.25000	0.25000	0.25000	0,0,m_z	0.00000	0.00000	5.10000
2	0.75000	0.75000	0.75000	0,0,m_z	0.00000	0.00000	5.10000

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	0.25000	0.75000	0,0,m_z	0.00000	0.00000	5.10000
2	0.75000	0.75000	0.25000	0,0,m_z	0.00000	0.00000	5.10000

Set of atoms in the unit cell related by symmetry with the magnetic atom Pr1:

Atom	x	y	z	Symmetry constraints on M	M_z
1	0.75000	0.25000	0.22320	0,0,m_z	-2.20000
2	0.75000	0.25000	0.72320	0,0,m_z	-2.20000
3	0.25000	0.75000	0.77680	0,0,m_z	-2.20000
4	0.25000	0.75000	0.27680	0,0,m_z	-2.20000

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

Atom	x	y	z	Symmetry constraints on M	M_z
1	0.00000	0.00000	0.00000	m_x,m_y,m_z	-5.10000
2	0.00000	0.50000	0.50000	-m_y,m_x,m_z	-5.10000
3	0.50000	0.00000	0.50000	m_y,-m_x,m_z	-5.10000
4	0.50000	0.50000	0.00000	-m_x,-m_y,m_z	-5.10000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom Sb1:

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:

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Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_z	\|M\|
Mn1	Mn	0.25000	0.25000	0.25000	2	0,0,m_z	5.1(1)	5.10
Mn2	Mn	0.25000	0.25000	0.75000	2	0,0,m_z	5.1	5.10
Pr1	Pr	0.75000	0.25000	0.22320	4	0,0,m_z	-2.2(1)	2.20
Mn3	Mn	0.00000	0.00000	0.00000	4	m_x,m_y,m_z	-5.1	5.10

label	dim. small irrep	dim. full irrep	action	number of modes
mGM1+	1	1	primary	6

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