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 }
(1/2,0,1/2) + set click here to show and hide
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 }
(1/2,0,0)' + set click here to show and hide
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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N	(x,y,z)	Seitz notation
1	x,y,z,+1	1
2	-x,-y,-z,+1	-1
3	-x,y,-z,+1	2₀₁₀
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	-1'
7	-x,y,-z,-1	2'₀₁₀
8	x,-y,z,-1	m'₀₁₀

Magnetic atoms:

Label	Atom type	x	y	z	Occupancy	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Mn1	Mn2+	0.25250	0.16590	0.15095	0.938	16	m_x,m_y,m_z	2.40(4)	0.0	-3.91(4)	4.62

Non-magnetic atoms:

Label	Atom type	x	y	z	Occupancy	Multiplicity
Li1	Li	0.25250	0.16590	0.15095	0.062	16
Si1	Si	0.12690	0.41370	0.15615	1.	16
Li2	Li	0.00450	0.16010	0.15000	1.	16
Li3	Li	0.11720	0.07700	0.35635	0.966	16
Mn2	Mn2+	0.11720	0.07700	0.35635	0.034	16
O1	O	0.12945	0.41160	0.31855	1.	16
O2	O	0.12580	0.55560	0.09795	1.	16
O3	O	0.01960	0.33890	0.10625	1.	16
O4	O	0.23235	0.34350	0.09905	1.	16

[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 Mn1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.25250	0.16590	0.15095	m_x,m_y,m_z	2.40000	0.00000	-3.91000
2	0.99750	0.66590	0.09905	-m_x,m_y,-m_z	-2.40000	0.00000	3.91000
3	0.74750	0.83410	0.84905	m_x,m_y,m_z	2.40000	0.00000	-3.91000
4	0.50250	0.33410	0.40095	-m_x,m_y,-m_z	-2.40000	0.00000	3.91000
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5	0.75250	0.16590	0.65095	m_x,m_y,m_z	2.40000	0.00000	-3.91000
6	0.49750	0.66590	0.59905	-m_x,m_y,-m_z	-2.40000	0.00000	3.91000
7	0.24750	0.83410	0.34905	m_x,m_y,m_z	2.40000	0.00000	-3.91000
8	0.00250	0.33410	0.90095	-m_x,m_y,-m_z	-2.40000	0.00000	3.91000
(1/2,0,0)' + set click here to show and hide
9	0.75250	0.16590	0.15095	-m_x,-m_y,-m_z	-2.40000	0.00000	3.91000
10	0.49750	0.66590	0.09905	m_x,-m_y,m_z	2.40000	0.00000	-3.91000
11	0.24750	0.83410	0.84905	-m_x,-m_y,-m_z	-2.40000	0.00000	3.91000
12	0.00250	0.33410	0.40095	m_x,-m_y,m_z	2.40000	0.00000	-3.91000
(0,0,1/2)' + set click here to show and hide
13	0.25250	0.16590	0.65095	-m_x,-m_y,-m_z	-2.40000	0.00000	3.91000
14	0.99750	0.66590	0.59905	m_x,-m_y,m_z	2.40000	0.00000	-3.91000
15	0.74750	0.83410	0.34905	-m_x,-m_y,-m_z	-2.40000	0.00000	3.91000
16	0.50250	0.33410	0.90095	m_x,-m_y,m_z	2.40000	0.00000	-3.91000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom Li1:

Atom	x	y	z
1	0.25250	0.16590	0.15095
2	0.99750	0.66590	0.09905
3	0.74750	0.83410	0.84905
4	0.50250	0.33410	0.40095
(1/2,0,1/2) + set click here to show and hide
5	0.75250	0.16590	0.65095
6	0.49750	0.66590	0.59905
7	0.24750	0.83410	0.34905
8	0.00250	0.33410	0.90095
(1/2,0,0)' + set click here to show and hide
9	0.75250	0.16590	0.15095
10	0.49750	0.66590	0.09905
11	0.24750	0.83410	0.84905
12	0.00250	0.33410	0.40095
(0,0,1/2)' + set click here to show and hide
13	0.25250	0.16590	0.65095
14	0.99750	0.66590	0.59905
15	0.74750	0.83410	0.34905
16	0.50250	0.33410	0.90095

Set of atoms in the unit cell related by symmetry with the atom Si1:

Atom	x	y	z
1	0.12690	0.41370	0.15615
2	0.12310	0.91370	0.09385
3	0.87310	0.58630	0.84385
4	0.37690	0.08630	0.40615
(1/2,0,1/2) + set click here to show and hide
5	0.62690	0.41370	0.65615
6	0.62310	0.91370	0.59385
7	0.37310	0.58630	0.34385
8	0.87690	0.08630	0.90615
(1/2,0,0)' + set click here to show and hide
9	0.62690	0.41370	0.15615
10	0.62310	0.91370	0.09385
11	0.37310	0.58630	0.84385
12	0.87690	0.08630	0.40615
(0,0,1/2)' + set click here to show and hide
13	0.12690	0.41370	0.65615
14	0.12310	0.91370	0.59385
15	0.87310	0.58630	0.34385
16	0.37690	0.08630	0.90615

Set of atoms in the unit cell related by symmetry with the atom Li2:

Atom	x	y	z
1	0.00450	0.16010	0.15000
2	0.24550	0.66010	0.10000
3	0.99550	0.83990	0.85000
4	0.25450	0.33990	0.40000
(1/2,0,1/2) + set click here to show and hide
5	0.50450	0.16010	0.65000
6	0.74550	0.66010	0.60000
7	0.49550	0.83990	0.35000
8	0.75450	0.33990	0.90000
(1/2,0,0)' + set click here to show and hide
9	0.50450	0.16010	0.15000
10	0.74550	0.66010	0.10000
11	0.49550	0.83990	0.85000
12	0.75450	0.33990	0.40000
(0,0,1/2)' + set click here to show and hide
13	0.00450	0.16010	0.65000
14	0.24550	0.66010	0.60000
15	0.99550	0.83990	0.35000
16	0.25450	0.33990	0.90000

Set of atoms in the unit cell related by symmetry with the atom Li3:

Atom	x	y	z
1	0.11720	0.07700	0.35635
2	0.13280	0.57700	0.89365
3	0.88280	0.92300	0.64365
4	0.36720	0.42300	0.60635
(1/2,0,1/2) + set click here to show and hide
5	0.61720	0.07700	0.85635
6	0.63280	0.57700	0.39365
7	0.38280	0.92300	0.14365
8	0.86720	0.42300	0.10635
(1/2,0,0)' + set click here to show and hide
9	0.61720	0.07700	0.35635
10	0.63280	0.57700	0.89365
11	0.38280	0.92300	0.64365
12	0.86720	0.42300	0.60635
(0,0,1/2)' + set click here to show and hide
13	0.11720	0.07700	0.85635
14	0.13280	0.57700	0.39365
15	0.88280	0.92300	0.14365
16	0.36720	0.42300	0.10635

Set of atoms in the unit cell related by symmetry with the atom Mn2:

Atom	x	y	z
1	0.11720	0.07700	0.35635
2	0.13280	0.57700	0.89365
3	0.88280	0.92300	0.64365
4	0.36720	0.42300	0.60635
(1/2,0,1/2) + set click here to show and hide
5	0.61720	0.07700	0.85635
6	0.63280	0.57700	0.39365
7	0.38280	0.92300	0.14365
8	0.86720	0.42300	0.10635
(1/2,0,0)' + set click here to show and hide
9	0.61720	0.07700	0.35635
10	0.63280	0.57700	0.89365
11	0.38280	0.92300	0.64365
12	0.86720	0.42300	0.60635
(0,0,1/2)' + set click here to show and hide
13	0.11720	0.07700	0.85635
14	0.13280	0.57700	0.39365
15	0.88280	0.92300	0.14365
16	0.36720	0.42300	0.10635

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

Atom	x	y	z
1	0.12945	0.41160	0.31855
2	0.12055	0.91160	0.93145
3	0.87055	0.58840	0.68145
4	0.37945	0.08840	0.56855
(1/2,0,1/2) + set click here to show and hide
5	0.62945	0.41160	0.81855
6	0.62055	0.91160	0.43145
7	0.37055	0.58840	0.18145
8	0.87945	0.08840	0.06855
(1/2,0,0)' + set click here to show and hide
9	0.62945	0.41160	0.31855
10	0.62055	0.91160	0.93145
11	0.37055	0.58840	0.68145
12	0.87945	0.08840	0.56855
(0,0,1/2)' + set click here to show and hide
13	0.12945	0.41160	0.81855
14	0.12055	0.91160	0.43145
15	0.87055	0.58840	0.18145
16	0.37945	0.08840	0.06855

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

Atom	x	y	z
1	0.12580	0.55560	0.09795
2	0.12420	0.05560	0.15205
3	0.87420	0.44440	0.90205
4	0.37580	0.94440	0.34795
(1/2,0,1/2) + set click here to show and hide
5	0.62580	0.55560	0.59795
6	0.62420	0.05560	0.65205
7	0.37420	0.44440	0.40205
8	0.87580	0.94440	0.84795
(1/2,0,0)' + set click here to show and hide
9	0.62580	0.55560	0.09795
10	0.62420	0.05560	0.15205
11	0.37420	0.44440	0.90205
12	0.87580	0.94440	0.34795
(0,0,1/2)' + set click here to show and hide
13	0.12580	0.55560	0.59795
14	0.12420	0.05560	0.65205
15	0.87420	0.44440	0.40205
16	0.37580	0.94440	0.84795

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

Atom	x	y	z
1	0.01960	0.33890	0.10625
2	0.23040	0.83890	0.14375
3	0.98040	0.66110	0.89375
4	0.26960	0.16110	0.35625
(1/2,0,1/2) + set click here to show and hide
5	0.51960	0.33890	0.60625
6	0.73040	0.83890	0.64375
7	0.48040	0.66110	0.39375
8	0.76960	0.16110	0.85625
(1/2,0,0)' + set click here to show and hide
9	0.51960	0.33890	0.10625
10	0.73040	0.83890	0.14375
11	0.48040	0.66110	0.89375
12	0.76960	0.16110	0.35625
(0,0,1/2)' + set click here to show and hide
13	0.01960	0.33890	0.60625
14	0.23040	0.83890	0.64375
15	0.98040	0.66110	0.39375
16	0.26960	0.16110	0.85625

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

Atom	x	y	z
1	0.23235	0.34350	0.09905
2	0.01765	0.84350	0.15095
3	0.76765	0.65650	0.90095
4	0.48235	0.15650	0.34905
(1/2,0,1/2) + set click here to show and hide
5	0.73235	0.34350	0.59905
6	0.51765	0.84350	0.65095
7	0.26765	0.65650	0.40095
8	0.98235	0.15650	0.84905
(1/2,0,0)' + set click here to show and hide
9	0.73235	0.34350	0.09905
10	0.51765	0.84350	0.15095
11	0.26765	0.65650	0.90095
12	0.98235	0.15650	0.34905
(0,0,1/2)' + set click here to show and hide
13	0.23235	0.34350	0.59905
14	0.01765	0.84350	0.65095
15	0.76765	0.65650	0.40095
16	0.48235	0.15650	0.84905

[Hide]

Label	Atom type	x	y	z	Occupancy	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Mn1	Mn2+	0.25250	0.16590	0.15095	0.938	16	m_x,m_y,m_z	2.40(4)	0.0	-3.91(4)	4.62

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

label	dim. small irrep	dim. full irrep	action
mY1+	1	1	primary

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

Li₂MnSiO₄ (#1.78)

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

Li2MnSiO4 (#1.78)

Li₂MnSiO₄ (#1.78)