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

[Hide]

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

Magnetic atoms:

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Fe1	Fe	0.12500	0.08149	0.10025	16	m_x,m_y,m_z	-2.50(2)	0.0	0.0	2.50

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
Li1_1	Li	0.24737	0.33132	0.14638	16
Li1_2	Li	0.75263	0.16868	0.39638	16
Si1	Si	0.12500	0.91608	0.34671	16
O1	O	0.12500	0.06359	0.39150	16
O2	O	0.12500	0.90959	0.18439	16
O3_1	O	0.23096	0.34388	0.34713	16
O3_2	O	0.76904	0.15612	0.59713	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 Fe1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.12500	0.08149	0.10025	m_x,m_y,m_z	-2.50000	0.00000	0.00000
2	0.12500	0.58149	0.14975	-m_x,m_y,-m_z	2.50000	0.00000	0.00000
3	0.87500	0.91851	0.89975	m_x,m_y,m_z	-2.50000	0.00000	0.00000
4	0.37500	0.41851	0.35025	-m_x,m_y,-m_z	2.50000	0.00000	0.00000
(1/2,0,1/2) + set click here to show and hide
5	0.62500	0.08149	0.60025	m_x,m_y,m_z	-2.50000	0.00000	0.00000
6	0.62500	0.58149	0.64975	-m_x,m_y,-m_z	2.50000	0.00000	0.00000
7	0.37500	0.91851	0.39975	m_x,m_y,m_z	-2.50000	0.00000	0.00000
8	0.87500	0.41851	0.85025	-m_x,m_y,-m_z	2.50000	0.00000	0.00000
(0,0,1/2)' + set click here to show and hide
9	0.12500	0.08149	0.60025	-m_x,-m_y,-m_z	2.50000	0.00000	0.00000
10	0.12500	0.58149	0.64975	m_x,-m_y,m_z	-2.50000	0.00000	0.00000
11	0.87500	0.91851	0.39975	-m_x,-m_y,-m_z	2.50000	0.00000	0.00000
12	0.37500	0.41851	0.85025	m_x,-m_y,m_z	-2.50000	0.00000	0.00000
(1/2,0,0)' + set click here to show and hide
13	0.62500	0.08149	0.10025	-m_x,-m_y,-m_z	2.50000	0.00000	0.00000
14	0.62500	0.58149	0.14975	m_x,-m_y,m_z	-2.50000	0.00000	0.00000
15	0.37500	0.91851	0.89975	-m_x,-m_y,-m_z	2.50000	0.00000	0.00000
16	0.87500	0.41851	0.35025	m_x,-m_y,m_z	-2.50000	0.00000	0.00000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom Li1_1:

Atom	x	y	z
1	0.24737	0.33132	0.14638
2	0.00263	0.83132	0.10362
3	0.75263	0.66868	0.85362
4	0.49737	0.16868	0.39638
(1/2,0,1/2) + set click here to show and hide
5	0.74737	0.33132	0.64638
6	0.50263	0.83132	0.60362
7	0.25263	0.66868	0.35362
8	0.99737	0.16868	0.89638
(0,0,1/2)' + set click here to show and hide
9	0.24737	0.33132	0.64638
10	0.00263	0.83132	0.60362
11	0.75263	0.66868	0.35362
12	0.49737	0.16868	0.89638
(1/2,0,0)' + set click here to show and hide
13	0.74737	0.33132	0.14638
14	0.50263	0.83132	0.10362
15	0.25263	0.66868	0.85362
16	0.99737	0.16868	0.39638

Set of atoms in the unit cell related by symmetry with the atom Li1_2:

Atom	x	y	z
1	0.75263	0.16868	0.39638
2	0.49737	0.66868	0.85362
3	0.24737	0.83132	0.60362
4	0.00263	0.33132	0.64638
(1/2,0,1/2) + set click here to show and hide
5	0.25263	0.16868	0.89638
6	0.99737	0.66868	0.35362
7	0.74737	0.83132	0.10362
8	0.50263	0.33132	0.14638
(0,0,1/2)' + set click here to show and hide
9	0.75263	0.16868	0.89638
10	0.49737	0.66868	0.35362
11	0.24737	0.83132	0.10362
12	0.00263	0.33132	0.14638
(1/2,0,0)' + set click here to show and hide
13	0.25263	0.16868	0.39638
14	0.99737	0.66868	0.85362
15	0.74737	0.83132	0.60362
16	0.50263	0.33132	0.64638

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

Atom	x	y	z
1	0.12500	0.91608	0.34671
2	0.12500	0.41608	0.90329
3	0.87500	0.08392	0.65329
4	0.37500	0.58392	0.59671
(1/2,0,1/2) + set click here to show and hide
5	0.62500	0.91608	0.84671
6	0.62500	0.41608	0.40329
7	0.37500	0.08392	0.15329
8	0.87500	0.58392	0.09671
(0,0,1/2)' + set click here to show and hide
9	0.12500	0.91608	0.84671
10	0.12500	0.41608	0.40329
11	0.87500	0.08392	0.15329
12	0.37500	0.58392	0.09671
(1/2,0,0)' + set click here to show and hide
13	0.62500	0.91608	0.34671
14	0.62500	0.41608	0.90329
15	0.37500	0.08392	0.65329
16	0.87500	0.58392	0.59671

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

Atom	x	y	z
1	0.12500	0.06359	0.39150
2	0.12500	0.56359	0.85850
3	0.87500	0.93641	0.60850
4	0.37500	0.43641	0.64150
(1/2,0,1/2) + set click here to show and hide
5	0.62500	0.06359	0.89150
6	0.62500	0.56359	0.35850
7	0.37500	0.93641	0.10850
8	0.87500	0.43641	0.14150
(0,0,1/2)' + set click here to show and hide
9	0.12500	0.06359	0.89150
10	0.12500	0.56359	0.35850
11	0.87500	0.93641	0.10850
12	0.37500	0.43641	0.14150
(1/2,0,0)' + set click here to show and hide
13	0.62500	0.06359	0.39150
14	0.62500	0.56359	0.85850
15	0.37500	0.93641	0.60850
16	0.87500	0.43641	0.64150

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

Atom	x	y	z
1	0.12500	0.90959	0.18439
2	0.12500	0.40959	0.06561
3	0.87500	0.09041	0.81561
4	0.37500	0.59041	0.43439
(1/2,0,1/2) + set click here to show and hide
5	0.62500	0.90959	0.68439
6	0.62500	0.40959	0.56561
7	0.37500	0.09041	0.31561
8	0.87500	0.59041	0.93439
(0,0,1/2)' + set click here to show and hide
9	0.12500	0.90959	0.68439
10	0.12500	0.40959	0.56561
11	0.87500	0.09041	0.31561
12	0.37500	0.59041	0.93439
(1/2,0,0)' + set click here to show and hide
13	0.62500	0.90959	0.18439
14	0.62500	0.40959	0.06561
15	0.37500	0.09041	0.81561
16	0.87500	0.59041	0.43439

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

Atom	x	y	z
1	0.23096	0.34388	0.34713
2	0.01904	0.84388	0.90287
3	0.76904	0.65612	0.65287
4	0.48096	0.15612	0.59713
(1/2,0,1/2) + set click here to show and hide
5	0.73096	0.34388	0.84713
6	0.51904	0.84388	0.40287
7	0.26904	0.65612	0.15287
8	0.98096	0.15612	0.09713
(0,0,1/2)' + set click here to show and hide
9	0.23096	0.34388	0.84713
10	0.01904	0.84388	0.40287
11	0.76904	0.65612	0.15287
12	0.48096	0.15612	0.09713
(1/2,0,0)' + set click here to show and hide
13	0.73096	0.34388	0.34713
14	0.51904	0.84388	0.90287
15	0.26904	0.65612	0.65287
16	0.98096	0.15612	0.59713

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

Atom	x	y	z
1	0.76904	0.15612	0.59713
2	0.48096	0.65612	0.65287
3	0.23096	0.84388	0.40287
4	0.01904	0.34388	0.84713
(1/2,0,1/2) + set click here to show and hide
5	0.26904	0.15612	0.09713
6	0.98096	0.65612	0.15287
7	0.73096	0.84388	0.90287
8	0.51904	0.34388	0.34713
(0,0,1/2)' + set click here to show and hide
9	0.76904	0.15612	0.09713
10	0.48096	0.65612	0.15287
11	0.23096	0.84388	0.90287
12	0.01904	0.34388	0.34713
(1/2,0,0)' + set click here to show and hide
13	0.26904	0.15612	0.59713
14	0.98096	0.65612	0.65287
15	0.73096	0.84388	0.40287
16	0.51904	0.34388	0.84713

[Hide]

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Fe1	Fe	0.12500	0.08149	0.10025	16	m_x,m_y,m_z	-2.50(2)	0.0	0.0	2.50

label	dim. full irrep	dim. small irrep	direction	action	number of modes
mT1	2	2	special	primary	3

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