MAGNDATA - Collection of Magnetic Structures

Transformation matrix from the parent setting (a_p,b_p,c_p) to the standard setting of the parent space group (a_pst,b_pst,c_pst):

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Transformation matrix from the setting of the parent structure (a_p,b_p,c_p) to the working setting (a,b,c):

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

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Transformation matrix from the working setting (a,b,c) to the standard setting of the magnetic space group (a_s,b_s,c_s):

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Symmetry operations of the magnetic point 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_z	\|M\|
Ni1	Ni	0.00000	0.00000	0.00000	2	m_x,m_y,m_z	1.04	-1.41	1.75
Nd1	Nd	0.00970	0.54450	0.74950	4	m_x,m_y,m_z	0.0	0.0	0.00
Mn1	Mn	0.00000	0.00000	0.50000	2	m_x,m_y,m_z	1.3	-1.75	2.18

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
O1	O	0.07870	0.01670	0.25750	4
O2	O	0.21650	0.29670	0.95800	4
O3	O	0.20300	0.28230	0.54040	4

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	1.04000	0.00000	-1.41000
2	0.50000	0.50000	0.50000	m_x,-m_y,m_z	1.04000	0.00000	-1.41000

Atom	x	y	z	Symmetry constraints on M
1	0.00970	0.54450	0.74950	m_x,m_y,m_z
2	0.99030	0.45550	0.25050	m_x,m_y,m_z
3	0.49030	0.04450	0.75050	m_x,-m_y,m_z
4	0.50970	0.95550	0.24950	m_x,-m_y,m_z

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.00000	0.50000	m_x,m_y,m_z	1.30000	0.00000	-1.75000
2	0.50000	0.50000	0.00000	m_x,-m_y,m_z	1.30000	0.00000	-1.75000

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_z	\|M\|
Ni1	Ni	0.00000	0.00000	0.00000	2	m_x,m_y,m_z	1.04	-1.41	1.75
Nd1	Nd	0.00970	0.54450	0.74950	4	m_x,m_y,m_z	0.0	0.0	0.00
Mn1	Mn	0.00000	0.00000	0.50000	2	m_x,m_y,m_z	1.3	-1.75	2.18

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	1.04000	0.00000	-1.41000
2	0.50000	0.50000	0.50000	m_x,-m_y,m_z	1.04000	0.00000	-1.41000

Atom	x	y	z	Symmetry constraints on M
1	0.00970	0.54450	0.74950	m_x,m_y,m_z
2	0.99030	0.45550	0.25050	m_x,m_y,m_z
3	0.49030	0.04450	0.75050	m_x,-m_y,m_z
4	0.50970	0.95550	0.24950	m_x,-m_y,m_z

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.00000	0.50000	m_x,m_y,m_z	1.30000	0.00000	-1.75000
2	0.50000	0.50000	0.00000	m_x,-m_y,m_z	1.30000	0.00000	-1.75000

label	dim. small irrep	dim. full irrep	action	number of modes
mGM2+	1	1	primary	9

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