MAGNDATA - Collection of Magnetic Structures

N	(x,y,z)	Seitz notation
1	x,y,z,+1	{ 1 \| 0 }
2	-x+1/2,-y,-z,+1	{ -1 \| 1/2 0 0 }
(1/2,1/2,0) + set click here to show and hide
3	x+1/2,y+1/2,z,+1	{ 1 \| 1/2 1/2 0 }
4	-x,-y+1/2,-z,+1	{ -1 \| 0 1/2 0 }
(0,1/2,0)' + set click here to show and hide
5	x,y+1/2,z,-1	{ 1' \| 0 1/2 0 }
6	-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
7	x+1/2,y,z,-1	{ 1' \| 1/2 0 0 }
8	-x,-y,-z,-1	{ -1' \| 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\|
Ni1_1	Ni	0.25000	0.00000	0.00000	4	m_x,m_y,m_z	1.30(5)	0.22(6)	0.43(22)	1.39
Ni1_2	Ni	0.00000	0.25000	0.50000	4	m_x,m_y,m_z	1.30(5)	0.22(6)	0.43(22)	1.39
Ir1_1	Ir	0.25000	0.00000	0.50000	4	m_x,m_y,m_z	0.14(6)	0.32(8)	0.14(24)	0.38
Ir1_2	Ir	0.00000	0.25000	0.00000	4	m_x,m_y,m_z	0.14(6)	0.32(8)	0.14(24)	0.38

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
La1_1	La	0.25000	0.27195	0.74980	8
La1_2	La	0.00000	0.52195	0.75020	8
O1_1	O	0.11000	0.09750	0.46000	8
O1_2	O	0.14000	0.34750	0.04000	8
O2_1	O	0.15000	0.35800	0.46000	8
O2_2	O	0.10000	0.60800	0.04000	8
O3_1	O	0.21000	0.49000	0.74000	8
O3_2	O	0.04000	0.74000	0.76000	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 Ni1_1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.25000	0.00000	0.00000	m_x,m_y,m_z	1.30000	0.22000	0.43000
(1/2,1/2,0) + set click here to show and hide
2	0.75000	0.50000	0.00000	m_x,m_y,m_z	1.30000	0.22000	0.43000
(0,1/2,0)' + set click here to show and hide
3	0.25000	0.50000	0.00000	-m_x,-m_y,-m_z	-1.30000	-0.22000	-0.43000
(1/2,0,0)' + set click here to show and hide
4	0.75000	0.00000	0.00000	-m_x,-m_y,-m_z	-1.30000	-0.22000	-0.43000

Set of atoms in the unit cell related by symmetry with the magnetic atom Ni1_2:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.25000	0.50000	m_x,m_y,m_z	1.30000	0.22000	0.43000
(1/2,1/2,0) + set click here to show and hide
2	0.50000	0.75000	0.50000	m_x,m_y,m_z	1.30000	0.22000	0.43000
(0,1/2,0)' + set click here to show and hide
3	0.00000	0.75000	0.50000	-m_x,-m_y,-m_z	-1.30000	-0.22000	-0.43000
(1/2,0,0)' + set click here to show and hide
4	0.50000	0.25000	0.50000	-m_x,-m_y,-m_z	-1.30000	-0.22000	-0.43000

Set of atoms in the unit cell related by symmetry with the magnetic atom Ir1_1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.25000	0.00000	0.50000	m_x,m_y,m_z	0.14000	0.32000	0.14000
(1/2,1/2,0) + set click here to show and hide
2	0.75000	0.50000	0.50000	m_x,m_y,m_z	0.14000	0.32000	0.14000
(0,1/2,0)' + set click here to show and hide
3	0.25000	0.50000	0.50000	-m_x,-m_y,-m_z	-0.14000	-0.32000	-0.14000
(1/2,0,0)' + set click here to show and hide
4	0.75000	0.00000	0.50000	-m_x,-m_y,-m_z	-0.14000	-0.32000	-0.14000

Set of atoms in the unit cell related by symmetry with the magnetic atom Ir1_2:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.25000	0.00000	m_x,m_y,m_z	0.14000	0.32000	0.14000
(1/2,1/2,0) + set click here to show and hide
2	0.50000	0.75000	0.00000	m_x,m_y,m_z	0.14000	0.32000	0.14000
(0,1/2,0)' + set click here to show and hide
3	0.00000	0.75000	0.00000	-m_x,-m_y,-m_z	-0.14000	-0.32000	-0.14000
(1/2,0,0)' + set click here to show and hide
4	0.50000	0.25000	0.00000	-m_x,-m_y,-m_z	-0.14000	-0.32000	-0.14000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom La1_1:

Atom	x	y	z
1	0.25000	0.27195	0.74980
2	0.25000	0.72805	0.25020
(1/2,1/2,0) + set click here to show and hide
3	0.75000	0.77195	0.74980
4	0.75000	0.22805	0.25020
(0,1/2,0)' + set click here to show and hide
5	0.25000	0.77195	0.74980
6	0.25000	0.22805	0.25020
(1/2,0,0)' + set click here to show and hide
7	0.75000	0.27195	0.74980
8	0.75000	0.72805	0.25020

Set of atoms in the unit cell related by symmetry with the atom La1_2:

Atom	x	y	z
1	0.00000	0.52195	0.75020
2	0.50000	0.47805	0.24980
(1/2,1/2,0) + set click here to show and hide
3	0.50000	0.02195	0.75020
4	0.00000	0.97805	0.24980
(0,1/2,0)' + set click here to show and hide
5	0.00000	0.02195	0.75020
6	0.50000	0.97805	0.24980
(1/2,0,0)' + set click here to show and hide
7	0.50000	0.52195	0.75020
8	0.00000	0.47805	0.24980

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

Atom	x	y	z
1	0.11000	0.09750	0.46000
2	0.39000	0.90250	0.54000
(1/2,1/2,0) + set click here to show and hide
3	0.61000	0.59750	0.46000
4	0.89000	0.40250	0.54000
(0,1/2,0)' + set click here to show and hide
5	0.11000	0.59750	0.46000
6	0.39000	0.40250	0.54000
(1/2,0,0)' + set click here to show and hide
7	0.61000	0.09750	0.46000
8	0.89000	0.90250	0.54000

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

Atom	x	y	z
1	0.14000	0.34750	0.04000
2	0.36000	0.65250	0.96000
(1/2,1/2,0) + set click here to show and hide
3	0.64000	0.84750	0.04000
4	0.86000	0.15250	0.96000
(0,1/2,0)' + set click here to show and hide
5	0.14000	0.84750	0.04000
6	0.36000	0.15250	0.96000
(1/2,0,0)' + set click here to show and hide
7	0.64000	0.34750	0.04000
8	0.86000	0.65250	0.96000

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

Atom	x	y	z
1	0.15000	0.35800	0.46000
2	0.35000	0.64200	0.54000
(1/2,1/2,0) + set click here to show and hide
3	0.65000	0.85800	0.46000
4	0.85000	0.14200	0.54000
(0,1/2,0)' + set click here to show and hide
5	0.15000	0.85800	0.46000
6	0.35000	0.14200	0.54000
(1/2,0,0)' + set click here to show and hide
7	0.65000	0.35800	0.46000
8	0.85000	0.64200	0.54000

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

Atom	x	y	z
1	0.10000	0.60800	0.04000
2	0.40000	0.39200	0.96000
(1/2,1/2,0) + set click here to show and hide
3	0.60000	0.10800	0.04000
4	0.90000	0.89200	0.96000
(0,1/2,0)' + set click here to show and hide
5	0.10000	0.10800	0.04000
6	0.40000	0.89200	0.96000
(1/2,0,0)' + set click here to show and hide
7	0.60000	0.60800	0.04000
8	0.90000	0.39200	0.96000

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

Atom	x	y	z
1	0.21000	0.49000	0.74000
2	0.29000	0.51000	0.26000
(1/2,1/2,0) + set click here to show and hide
3	0.71000	0.99000	0.74000
4	0.79000	0.01000	0.26000
(0,1/2,0)' + set click here to show and hide
5	0.21000	0.99000	0.74000
6	0.29000	0.01000	0.26000
(1/2,0,0)' + set click here to show and hide
7	0.71000	0.49000	0.74000
8	0.79000	0.51000	0.26000

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

Atom	x	y	z
1	0.04000	0.74000	0.76000
2	0.46000	0.26000	0.24000
(1/2,1/2,0) + set click here to show and hide
3	0.54000	0.24000	0.76000
4	0.96000	0.76000	0.24000
(0,1/2,0)' + set click here to show and hide
5	0.04000	0.24000	0.76000
6	0.46000	0.76000	0.24000
(1/2,0,0)' + set click here to show and hide
7	0.54000	0.74000	0.76000
8	0.96000	0.26000	0.24000

[Hide]

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Ni1_1	Ni	0.25000	0.00000	0.00000	4	m_x,m_y,m_z	1.30(5)	0.22(6)	0.43(22)	1.39
Ni1_2	Ni	0.00000	0.25000	0.50000	4	m_x,m_y,m_z	1.30(5)	0.22(6)	0.43(22)	1.39
Ir1_1	Ir	0.25000	0.00000	0.50000	4	m_x,m_y,m_z	0.14(6)	0.32(8)	0.14(24)	0.38
Ir1_2	Ir	0.00000	0.25000	0.00000	4	m_x,m_y,m_z	0.14(6)	0.32(8)	0.14(24)	0.38

[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: