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_x	M_y	M_z	\|M\|
Ni1	Ni	0.18400	0.62050	0.02370	4	m_x,m_y,m_z	-0.13(6)	0.18(10)	1.92(4)	1.98
Ni2	Ni	0.00000	0.00000	0.00000	2	m_x,m_y,m_z	0.16(10)	0.18(10)	2.01(6)	1.96

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
Ca1	Ca	0.50000	0.00000	0.00000	2
P1	P	0.87940	0.70210	0.19100	4
P2	P	0.60480	0.43330	0.20930	4
O1	O	0.39210	0.47780	0.19630	4
O2	O	0.01060	0.20980	0.13460	4
O3	O	0.97280	0.57810	0.11710	4
O4	O	0.67310	0.62470	0.17340	4
O5	O	0.61960	0.29990	0.08680	4
O6	O	0.27180	0.88320	0.13230	4
O7	O	0.82850	0.88010	0.10330	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 Ni1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.18400	0.62050	0.02370	m_x,m_y,m_z	-0.13000	0.18000	1.92000
2	0.81600	0.12050	0.47630	-m_x,m_y,-m_z	0.13000	0.18000	-1.92000
3	0.81600	0.37950	0.97630	m_x,m_y,m_z	-0.13000	0.18000	1.92000
4	0.18400	0.87950	0.52370	-m_x,m_y,-m_z	0.13000	0.18000	-1.92000

Set of atoms in the unit cell related by symmetry with the magnetic atom Ni2:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.00000	0.00000	m_x,m_y,m_z	0.16000	0.18000	2.01000
2	0.00000	0.50000	0.50000	-m_x,m_y,-m_z	-0.16000	0.18000	-2.01000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom Ca1:

Atom	x	y	z
1	0.50000	0.00000	0.00000
2	0.50000	0.50000	0.50000

Set of atoms in the unit cell related by symmetry with the atom P1:

Set of atoms in the unit cell related by symmetry with the atom P2:

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:

Set of atoms in the unit cell related by symmetry with the atom O7:

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Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Ni1	Ni	0.18400	0.62050	0.02370	4	m_x,m_y,m_z	-0.13(6)	0.18(10)	1.92(4)	1.98
Ni2	Ni	0.00000	0.00000	0.00000	2	m_x,m_y,m_z	0.16(10)	0.18(10)	2.01(6)	1.96

label	dim. small irrep	dim. full irrep	action
mGM1+	1	1	primary

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