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_y	\|M\|
Nd1_1	Nd	0.50000	0.43600	0.75000	2	0,0,m_z	0.0	0.0	0.00
Nd1_2	Nd	0.00000	0.06400	0.25000	2	0,0,m_z	0.0	0.0	0.00
Mn1_1	Mn	0.50000	0.00000	0.00000	2	m_x,m_y,m_z	-1.01	1.38	1.71
Mn1_2	Mn	0.00000	0.50000	0.00000	2	m_x,m_y,m_z	-1.01	1.38	1.71

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
O1_1	O	0.56800	0.02700	0.75000	2
O1_2	O	0.06800	0.47300	0.25000	2
O2_1	O	0.70100	0.66900	0.04600	4
O2_2	O	0.20100	0.83100	0.95400	4

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.50000	0.43600	0.75000	0,0,m_z	0.00000	0.00000	0.00000
2	0.50000	0.56400	0.25000	0,0,m_z	0.00000	0.00000	0.00000

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.06400	0.25000	0,0,m_z	0.00000	0.00000	0.00000
2	0.00000	0.93600	0.75000	0,0,m_z	0.00000	0.00000	0.00000

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.50000	0.00000	0.00000	m_x,m_y,m_z	-1.01000	1.38000	0.00000
2	0.50000	0.00000	0.50000	-m_x,-m_y,m_z	1.01000	-1.38000	0.00000

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.50000	0.00000	m_x,m_y,m_z	-1.01000	1.38000	0.00000
2	0.00000	0.50000	0.50000	-m_x,-m_y,m_z	1.01000	-1.38000	0.00000

Atom	x	y	z
1	0.56800	0.02700	0.75000
2	0.43200	0.97300	0.25000

Atom	x	y	z
1	0.06800	0.47300	0.25000
2	0.93200	0.52700	0.75000

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	\|M\|
Nd1_1	Nd	0.50000	0.43600	0.75000	2	0,0,m_z	0.0	0.0	0.00
Nd1_2	Nd	0.00000	0.06400	0.25000	2	0,0,m_z	0.0	0.0	0.00
Mn1_1	Mn	0.50000	0.00000	0.00000	2	m_x,m_y,m_z	-1.01	1.38	1.71
Mn1_2	Mn	0.00000	0.50000	0.00000	2	m_x,m_y,m_z	-1.01	1.38	1.71

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.50000	0.43600	0.75000	0,0,m_z	0.00000	0.00000	0.00000
2	0.50000	0.56400	0.25000	0,0,m_z	0.00000	0.00000	0.00000

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.06400	0.25000	0,0,m_z	0.00000	0.00000	0.00000
2	0.00000	0.93600	0.75000	0,0,m_z	0.00000	0.00000	0.00000

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.50000	0.00000	0.00000	m_x,m_y,m_z	-1.01000	1.38000	0.00000
2	0.50000	0.00000	0.50000	-m_x,-m_y,m_z	1.01000	-1.38000	0.00000

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.50000	0.00000	m_x,m_y,m_z	-1.01000	1.38000	0.00000
2	0.00000	0.50000	0.50000	-m_x,-m_y,m_z	1.01000	-1.38000	0.00000

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