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+1/4,y+1/2,-z+1/4,+1	{ 2₀₁₀ \| 1/4 1/2 1/4 }
3	-x,-y,-z,+1	{ -1 \| 0 }
4	x+1/4,-y+1/2,z+1/4,+1	{ m₀₁₀ \| 1/4 1/2 1/4 }
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5	x+1/2,y,z+1/2,+1	{ 1 \| 1/2 0 1/2 }
6	-x+3/4,y+1/2,-z+3/4,+1	{ 2₀₁₀ \| 3/4 1/2 3/4 }
7	-x+1/2,-y,-z+1/2,+1	{ -1 \| 1/2 0 1/2 }
8	x+3/4,-y+1/2,z+3/4,+1	{ m₀₁₀ \| 3/4 1/2 3/4 }
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9	x+1/2,y,z,-1	{ 1' \| 1/2 0 0 }
10	-x+3/4,y+1/2,-z+1/4,-1	{ 2'₀₁₀ \| 3/4 1/2 1/4 }
11	-x+1/2,-y,-z,-1	{ -1' \| 1/2 0 0 }
12	x+3/4,-y+1/2,z+1/4,-1	{ m'₀₁₀ \| 3/4 1/2 1/4 }
(0,0,1/2)' + set click here to show and hide
13	x,y,z+1/2,-1	{ 1' \| 0 0 1/2 }
14	-x+1/4,y+1/2,-z+3/4,-1	{ 2'₀₁₀ \| 1/4 1/2 3/4 }
15	-x,-y,-z+1/2,-1	{ -1' \| 0 0 1/2 }
16	x+1/4,-y+1/2,z+3/4,-1	{ m'₀₁₀ \| 1/4 1/2 3/4 }

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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	-1
4	x,-y,z,+1	m₀₁₀
1' + set click here to show and hide
5	x,y,z,-1	1'
6	-x,y,-z,-1	2'₀₁₀
7	-x,-y,-z,-1	-1'
8	x,-y,z,-1	m'₀₁₀

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Magnetic atoms:

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Cu1	Cu	0.00000	0.00000	0.00000	8	m_x,m_y,m_z	-0.15	0.49	0.0	0.51

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
Sb1	Sb	0.00055	0.00800	0.16690	16
O1	O	0.15650	0.29830	0.00085	16
O2	O	0.14955	0.31760	0.16455	16
O3	O	0.34940	0.70850	0.16240	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 Cu1:

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	-0.15000	0.49000	0.00000
2	0.25000	0.50000	0.25000	-m_x,m_y,-m_z	0.15000	0.49000	0.00000
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3	0.50000	0.00000	0.50000	m_x,m_y,m_z	-0.15000	0.49000	0.00000
4	0.75000	0.50000	0.75000	-m_x,m_y,-m_z	0.15000	0.49000	0.00000
(1/2,0,0)' + set click here to show and hide
5	0.50000	0.00000	0.00000	-m_x,-m_y,-m_z	0.15000	-0.49000	0.00000
6	0.75000	0.50000	0.25000	m_x,-m_y,m_z	-0.15000	-0.49000	0.00000
(0,0,1/2)' + set click here to show and hide
7	0.00000	0.00000	0.50000	-m_x,-m_y,-m_z	0.15000	-0.49000	0.00000
8	0.25000	0.50000	0.75000	m_x,-m_y,m_z	-0.15000	-0.49000	0.00000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom Sb1:

Atom	x	y	z
1	0.00055	0.00800	0.16690
2	0.24945	0.50800	0.08310
3	0.99945	0.99200	0.83310
4	0.25055	0.49200	0.41690
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5	0.50055	0.00800	0.66690
6	0.74945	0.50800	0.58310
7	0.49945	0.99200	0.33310
8	0.75055	0.49200	0.91690
(1/2,0,0)' + set click here to show and hide
9	0.50055	0.00800	0.16690
10	0.74945	0.50800	0.08310
11	0.49945	0.99200	0.83310
12	0.75055	0.49200	0.41690
(0,0,1/2)' + set click here to show and hide
13	0.00055	0.00800	0.66690
14	0.24945	0.50800	0.58310
15	0.99945	0.99200	0.33310
16	0.25055	0.49200	0.91690

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

Atom	x	y	z
1	0.15650	0.29830	0.00085
2	0.09350	0.79830	0.24915
3	0.84350	0.70170	0.99915
4	0.40650	0.20170	0.25085
(1/2,0,1/2) + set click here to show and hide
5	0.65650	0.29830	0.50085
6	0.59350	0.79830	0.74915
7	0.34350	0.70170	0.49915
8	0.90650	0.20170	0.75085
(1/2,0,0)' + set click here to show and hide
9	0.65650	0.29830	0.00085
10	0.59350	0.79830	0.24915
11	0.34350	0.70170	0.99915
12	0.90650	0.20170	0.25085
(0,0,1/2)' + set click here to show and hide
13	0.15650	0.29830	0.50085
14	0.09350	0.79830	0.74915
15	0.84350	0.70170	0.49915
16	0.40650	0.20170	0.75085

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

Atom	x	y	z
1	0.14955	0.31760	0.16455
2	0.10045	0.81760	0.08545
3	0.85045	0.68240	0.83545
4	0.39955	0.18240	0.41455
(1/2,0,1/2) + set click here to show and hide
5	0.64955	0.31760	0.66455
6	0.60045	0.81760	0.58545
7	0.35045	0.68240	0.33545
8	0.89955	0.18240	0.91455
(1/2,0,0)' + set click here to show and hide
9	0.64955	0.31760	0.16455
10	0.60045	0.81760	0.08545
11	0.35045	0.68240	0.83545
12	0.89955	0.18240	0.41455
(0,0,1/2)' + set click here to show and hide
13	0.14955	0.31760	0.66455
14	0.10045	0.81760	0.58545
15	0.85045	0.68240	0.33545
16	0.39955	0.18240	0.91455

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

Atom	x	y	z
1	0.34940	0.70850	0.16240
2	0.90060	0.20850	0.08760
3	0.65060	0.29150	0.83760
4	0.59940	0.79150	0.41240
(1/2,0,1/2) + set click here to show and hide
5	0.84940	0.70850	0.66240
6	0.40060	0.20850	0.58760
7	0.15060	0.29150	0.33760
8	0.09940	0.79150	0.91240
(1/2,0,0)' + set click here to show and hide
9	0.84940	0.70850	0.16240
10	0.40060	0.20850	0.08760
11	0.15060	0.29150	0.83760
12	0.09940	0.79150	0.41240
(0,0,1/2)' + set click here to show and hide
13	0.34940	0.70850	0.66240
14	0.90060	0.20850	0.58760
15	0.65060	0.29150	0.33760
16	0.59940	0.79150	0.91240

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Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Cu1	Cu	0.00000	0.00000	0.00000	8	m_x,m_y,m_z	-0.15	0.49	0.0	0.51

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