MAGNDATA - Collection of Magnetic Structures

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

N	(x,y,z)	Seitz notation
1	x,y,z,+1	{ 1 \| 0 }
2	-x+1/2,y+1/2,-z+1/2,+1	{ 2₀₁₀ \| 1/2 1/2 1/2 }
3	-x,-y,z+1/2,+1	{ 2₀₀₁ \| 0 0 1/2 }
4	x+1/2,-y+1/2,-z,+1	{ 2₁₀₀ \| 1/2 1/2 0 }
5	-x,-y,-z,+1	{ -1 \| 0 }
6	x+1/2,-y+1/2,z+1/2,+1	{ m₀₁₀ \| 1/2 1/2 1/2 }
7	x,y,-z+1/2,+1	{ m₀₀₁ \| 0 0 1/2 }
8	-x+1/2,y+1/2,z,+1	{ m₁₀₀ \| 1/2 1/2 0 }
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9	x,y,z+1/2,-1	{ 1' \| 0 0 1/2 }
10	-x+1/2,y+1/2,-z,-1	{ 2'₀₁₀ \| 1/2 1/2 0 }
11	-x,-y,z,-1	{ 2'₀₀₁ \| 0 }
12	x+1/2,-y+1/2,-z+1/2,-1	{ 2'₁₀₀ \| 1/2 1/2 1/2 }
13	-x,-y,-z+1/2,-1	{ -1' \| 0 0 1/2 }
14	x+1/2,-y+1/2,z,-1	{ m'₀₁₀ \| 1/2 1/2 0 }
15	x,y,-z,-1	{ m'₀₀₁ \| 0 }
16	-x+1/2,y+1/2,z+1/2,-1	{ m'₁₀₀ \| 1/2 1/2 1/2 }

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

N	(x,y,z)	Seitz notation
1	x,y,z,+1	1
2	-x,y,-z,+1	2₀₁₀
3	-x,-y,z,+1	2₀₀₁
4	x,-y,-z,+1	2₁₀₀
5	-x,-y,-z,+1	-1
6	x,-y,z,+1	m₀₁₀
7	x,y,-z,+1	m₀₀₁
8	-x,y,z,+1	m₁₀₀
1' + set click here to show and hide
9	x,y,z,-1	1'
10	-x,y,-z,-1	2'₀₁₀
11	-x,-y,z,-1	2'₀₀₁
12	x,-y,-z,-1	2'₁₀₀
13	-x,-y,-z,-1	-1'
14	x,-y,z,-1	m'₀₁₀
15	x,y,-z,-1	m'₀₀₁
16	-x,y,z,-1	m'₁₀₀

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Magnetic atoms:

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Nd1	Nd	0.14610	0.17530	0.00000	8	m_x,m_y,0	0.89(2)	-2.18(1)	0.0	2.35
Cr1	Cr	0.00000	0.50000	0.12890	8	m_x,m_y,0	0.14(2)	-0.24(1)	0.0	0.28

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
Ge1	Ge	0.38700	0.35790	0.25000	8
O1	O	0.00000	0.00000	0.14420	8
O2	O	0.16450	0.44890	0.00000	8
O3	O	0.16620	0.42480	0.25000	8
O4	O	0.39950	0.21640	0.12935	16

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:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.14610	0.17530	0.00000	m_x,m_y,0	0.89000	-2.18000	0.00000
2	0.35390	0.67530	0.50000	-m_x,m_y,0	-0.89000	-2.18000	0.00000
3	0.85390	0.82470	0.50000	-m_x,-m_y,0	-0.89000	2.18000	0.00000
4	0.64610	0.32470	0.00000	m_x,-m_y,0	0.89000	2.18000	0.00000
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5	0.14610	0.17530	0.50000	-m_x,-m_y,0	-0.89000	2.18000	0.00000
6	0.35390	0.67530	0.00000	m_x,-m_y,0	0.89000	2.18000	0.00000
7	0.85390	0.82470	0.00000	m_x,m_y,0	0.89000	-2.18000	0.00000
8	0.64610	0.32470	0.50000	-m_x,m_y,0	-0.89000	-2.18000	0.00000

Set of atoms in the unit cell related by symmetry with the magnetic atom Cr1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.50000	0.12890	m_x,m_y,0	0.14000	-0.24000	0.00000
2	0.50000	0.00000	0.37110	-m_x,m_y,0	-0.14000	-0.24000	0.00000
3	0.00000	0.50000	0.87110	m_x,m_y,0	0.14000	-0.24000	0.00000
4	0.50000	0.00000	0.62890	-m_x,m_y,0	-0.14000	-0.24000	0.00000
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5	0.00000	0.50000	0.62890	-m_x,-m_y,0	-0.14000	0.24000	0.00000
6	0.50000	0.00000	0.87110	m_x,-m_y,0	0.14000	0.24000	0.00000
7	0.00000	0.50000	0.37110	-m_x,-m_y,0	-0.14000	0.24000	0.00000
8	0.50000	0.00000	0.12890	m_x,-m_y,0	0.14000	0.24000	0.00000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom Ge1:

Atom	x	y	z
1	0.38700	0.35790	0.25000
2	0.11300	0.85790	0.25000
3	0.61300	0.64210	0.75000
4	0.88700	0.14210	0.75000
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5	0.38700	0.35790	0.75000
6	0.11300	0.85790	0.75000
7	0.61300	0.64210	0.25000
8	0.88700	0.14210	0.25000

Set of atoms in the unit cell related by symmetry with the atom O1:

Atom	x	y	z
1	0.00000	0.00000	0.14420
2	0.50000	0.50000	0.35580
3	0.00000	0.00000	0.85580
4	0.50000	0.50000	0.64420
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5	0.00000	0.00000	0.64420
6	0.50000	0.50000	0.85580
7	0.00000	0.00000	0.35580
8	0.50000	0.50000	0.14420

Set of atoms in the unit cell related by symmetry with the atom O2:

Atom	x	y	z
1	0.16450	0.44890	0.00000
2	0.33550	0.94890	0.50000
3	0.83550	0.55110	0.50000
4	0.66450	0.05110	0.00000
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5	0.16450	0.44890	0.50000
6	0.33550	0.94890	0.00000
7	0.83550	0.55110	0.00000
8	0.66450	0.05110	0.50000

Set of atoms in the unit cell related by symmetry with the atom O3:

Atom	x	y	z
1	0.16620	0.42480	0.25000
2	0.33380	0.92480	0.25000
3	0.83380	0.57520	0.75000
4	0.66620	0.07520	0.75000
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5	0.16620	0.42480	0.75000
6	0.33380	0.92480	0.75000
7	0.83380	0.57520	0.25000
8	0.66620	0.07520	0.25000

Set of atoms in the unit cell related by symmetry with the atom O4:

Atom	x	y	z
1	0.39950	0.21640	0.12935
2	0.10050	0.71640	0.37065
3	0.60050	0.78360	0.62935
4	0.89950	0.28360	0.87065
5	0.60050	0.78360	0.87065
6	0.89950	0.28360	0.62935
7	0.39950	0.21640	0.37065
8	0.10050	0.71640	0.12935
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9	0.39950	0.21640	0.62935
10	0.10050	0.71640	0.87065
11	0.60050	0.78360	0.12935
12	0.89950	0.28360	0.37065
13	0.60050	0.78360	0.37065
14	0.89950	0.28360	0.12935
15	0.39950	0.21640	0.87065
16	0.10050	0.71640	0.62935

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Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Nd1	Nd	0.14610	0.17530	0.00000	8	m_x,m_y,0	0.89(2)	-2.18(1)	0.0	2.35
Cr1	Cr	0.00000	0.50000	0.12890	8	m_x,m_y,0	0.14(2)	-0.24(1)	0.0	0.28

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