MAGNDATA - Collection of Magnetic Structures

N	(x,y,z)	Seitz notation
1	x,y,z,+1	{ 1 \| 0 }
2	-x,-y,-z,+1	{ -1 \| 0 }
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3	x+1/2,y+1/2,z,+1	{ 1 \| 1/2 1/2 0 }
4	-x+1/2,-y+1/2,-z,+1	{ -1 \| 1/2 1/2 0 }
(1/2,0,0)' + set click here to show and hide
5	x+1/2,y,z,-1	{ 1' \| 1/2 0 0 }
6	-x+1/2,-y,-z,-1	{ -1' \| 1/2 0 0 }
(0,1/2,0)' + set click here to show and hide
7	x,y+1/2,z,-1	{ 1' \| 0 1/2 0 }
8	-x,-y+1/2,-z,-1	{ -1' \| 0 1/2 0 }

N	(x,y,z)	Seitz notation
1	x,y,z,+1	1
2	-x,-y,-z,+1	-1
1' + set click here to show and hide
3	x,y,z,-1	1'
4	-x,-y,-z,-1	-1'

Magnetic atoms:

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Nd1_1	Nd	0.24090	0.03490	0.25330	8	m_x,m_y,m_z	0.2(2)	1.16(9)	-1.1(1)	1.61
Nd1_2	Nd	0.00910	0.28490	0.24670	8	m_x,m_y,m_z	-0.2(2)	1.16(9)	1.1(1)	1.61
Os1_1	Os	0.00000	0.00000	0.50000	4	m_x,m_y,m_z	0.0	-0.9(1)	0.0	0.90
Os1_2	Os	0.75000	0.25000	0.00000	4	m_x,m_y,m_z	0.0	-0.9(1)	0.0	0.90

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
Na1_1	Na	0.00000	0.00000	0.00000	4
Na1_2	Na	0.75000	0.25000	0.50000	4
O1_1	O	0.10430	0.16340	0.05040	8
O1_2	O	0.64570	0.41340	0.44960	8
O2_1	O	0.80775	0.22490	0.23070	8
O2_2	O	0.94225	0.47490	0.26930	8
O3_1	O	0.66900	0.39025	0.06580	8
O3_2	O	0.58100	0.14025	0.43420	8

[Show all atoms in unit cell and their moment relations]

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 Nd1_1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.24090	0.03490	0.25330	m_x,m_y,m_z	0.20000	1.16000	-1.10000
2	0.75910	0.96510	0.74670	m_x,m_y,m_z	0.20000	1.16000	-1.10000
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3	0.74090	0.53490	0.25330	m_x,m_y,m_z	0.20000	1.16000	-1.10000
4	0.25910	0.46510	0.74670	m_x,m_y,m_z	0.20000	1.16000	-1.10000
(1/2,0,0)' + set click here to show and hide
5	0.74090	0.03490	0.25330	-m_x,-m_y,-m_z	-0.20000	-1.16000	1.10000
6	0.25910	0.96510	0.74670	-m_x,-m_y,-m_z	-0.20000	-1.16000	1.10000
(0,1/2,0)' + set click here to show and hide
7	0.24090	0.53490	0.25330	-m_x,-m_y,-m_z	-0.20000	-1.16000	1.10000
8	0.75910	0.46510	0.74670	-m_x,-m_y,-m_z	-0.20000	-1.16000	1.10000

Set of atoms in the unit cell related by symmetry with the magnetic atom Nd1_2:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00910	0.28490	0.24670	m_x,m_y,m_z	-0.20000	1.16000	1.10000
2	0.99090	0.71510	0.75330	m_x,m_y,m_z	-0.20000	1.16000	1.10000
(1/2,1/2,0) + set click here to show and hide
3	0.50910	0.78490	0.24670	m_x,m_y,m_z	-0.20000	1.16000	1.10000
4	0.49090	0.21510	0.75330	m_x,m_y,m_z	-0.20000	1.16000	1.10000
(1/2,0,0)' + set click here to show and hide
5	0.50910	0.28490	0.24670	-m_x,-m_y,-m_z	0.20000	-1.16000	-1.10000
6	0.49090	0.71510	0.75330	-m_x,-m_y,-m_z	0.20000	-1.16000	-1.10000
(0,1/2,0)' + set click here to show and hide
7	0.00910	0.78490	0.24670	-m_x,-m_y,-m_z	0.20000	-1.16000	-1.10000
8	0.99090	0.21510	0.75330	-m_x,-m_y,-m_z	0.20000	-1.16000	-1.10000

Set of atoms in the unit cell related by symmetry with the magnetic atom Os1_1:

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	0.00000	-0.90000	0.00000
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2	0.50000	0.50000	0.50000	m_x,m_y,m_z	0.00000	-0.90000	0.00000
(1/2,0,0)' + set click here to show and hide
3	0.50000	0.00000	0.50000	-m_x,-m_y,-m_z	0.00000	0.90000	0.00000
(0,1/2,0)' + set click here to show and hide
4	0.00000	0.50000	0.50000	-m_x,-m_y,-m_z	0.00000	0.90000	0.00000

Set of atoms in the unit cell related by symmetry with the magnetic atom Os1_2:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.75000	0.25000	0.00000	m_x,m_y,m_z	0.00000	-0.90000	0.00000
(1/2,1/2,0) + set click here to show and hide
2	0.25000	0.75000	0.00000	m_x,m_y,m_z	0.00000	-0.90000	0.00000
(1/2,0,0)' + set click here to show and hide
3	0.25000	0.25000	0.00000	-m_x,-m_y,-m_z	0.00000	0.90000	0.00000
(0,1/2,0)' + set click here to show and hide
4	0.75000	0.75000	0.00000	-m_x,-m_y,-m_z	0.00000	0.90000	0.00000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom Na1_1:

Atom	x	y	z
1	0.00000	0.00000	0.00000
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2	0.50000	0.50000	0.00000
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3	0.50000	0.00000	0.00000
(0,1/2,0)' + set click here to show and hide
4	0.00000	0.50000	0.00000

Set of atoms in the unit cell related by symmetry with the atom Na1_2:

Atom	x	y	z
1	0.75000	0.25000	0.50000
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2	0.25000	0.75000	0.50000
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3	0.25000	0.25000	0.50000
(0,1/2,0)' + set click here to show and hide
4	0.75000	0.75000	0.50000

Set of atoms in the unit cell related by symmetry with the atom O1_1:

Atom	x	y	z
1	0.10430	0.16340	0.05040
2	0.89570	0.83660	0.94960
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3	0.60430	0.66340	0.05040
4	0.39570	0.33660	0.94960
(1/2,0,0)' + set click here to show and hide
5	0.60430	0.16340	0.05040
6	0.39570	0.83660	0.94960
(0,1/2,0)' + set click here to show and hide
7	0.10430	0.66340	0.05040
8	0.89570	0.33660	0.94960

Set of atoms in the unit cell related by symmetry with the atom O1_2:

Atom	x	y	z
1	0.64570	0.41340	0.44960
2	0.35430	0.58660	0.55040
(1/2,1/2,0) + set click here to show and hide
3	0.14570	0.91340	0.44960
4	0.85430	0.08660	0.55040
(1/2,0,0)' + set click here to show and hide
5	0.14570	0.41340	0.44960
6	0.85430	0.58660	0.55040
(0,1/2,0)' + set click here to show and hide
7	0.64570	0.91340	0.44960
8	0.35430	0.08660	0.55040

Set of atoms in the unit cell related by symmetry with the atom O2_1:

Atom	x	y	z
1	0.80775	0.22490	0.23070
2	0.19225	0.77510	0.76930
(1/2,1/2,0) + set click here to show and hide
3	0.30775	0.72490	0.23070
4	0.69225	0.27510	0.76930
(1/2,0,0)' + set click here to show and hide
5	0.30775	0.22490	0.23070
6	0.69225	0.77510	0.76930
(0,1/2,0)' + set click here to show and hide
7	0.80775	0.72490	0.23070
8	0.19225	0.27510	0.76930

Set of atoms in the unit cell related by symmetry with the atom O2_2:

Atom	x	y	z
1	0.94225	0.47490	0.26930
2	0.05775	0.52510	0.73070
(1/2,1/2,0) + set click here to show and hide
3	0.44225	0.97490	0.26930
4	0.55775	0.02510	0.73070
(1/2,0,0)' + set click here to show and hide
5	0.44225	0.47490	0.26930
6	0.55775	0.52510	0.73070
(0,1/2,0)' + set click here to show and hide
7	0.94225	0.97490	0.26930
8	0.05775	0.02510	0.73070

Set of atoms in the unit cell related by symmetry with the atom O3_1:

Atom	x	y	z
1	0.66900	0.39025	0.06580
2	0.33100	0.60975	0.93420
(1/2,1/2,0) + set click here to show and hide
3	0.16900	0.89025	0.06580
4	0.83100	0.10975	0.93420
(1/2,0,0)' + set click here to show and hide
5	0.16900	0.39025	0.06580
6	0.83100	0.60975	0.93420
(0,1/2,0)' + set click here to show and hide
7	0.66900	0.89025	0.06580
8	0.33100	0.10975	0.93420

Set of atoms in the unit cell related by symmetry with the atom O3_2:

Atom	x	y	z
1	0.58100	0.14025	0.43420
2	0.41900	0.85975	0.56580
(1/2,1/2,0) + set click here to show and hide
3	0.08100	0.64025	0.43420
4	0.91900	0.35975	0.56580
(1/2,0,0)' + set click here to show and hide
5	0.08100	0.14025	0.43420
6	0.91900	0.85975	0.56580
(0,1/2,0)' + set click here to show and hide
7	0.58100	0.64025	0.43420
8	0.41900	0.35975	0.56580

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Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Nd1_1	Nd	0.24090	0.03490	0.25330	8	m_x,m_y,m_z	0.2(2)	1.16(9)	-1.1(1)	1.61
Nd1_2	Nd	0.00910	0.28490	0.24670	8	m_x,m_y,m_z	-0.2(2)	1.16(9)	1.1(1)	1.61
Os1_1	Os	0.00000	0.00000	0.50000	4	m_x,m_y,m_z	0.0	-0.9(1)	0.0	0.90
Os1_2	Os	0.75000	0.25000	0.00000	4	m_x,m_y,m_z	0.0	-0.9(1)	0.0	0.90

[Show all magnetic atoms in unit cell and their moment relations]

Positions and magnetic moments of all atoms in unit cell, with magnetic moment relations explicitly given: