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,-y,z+1/2,+1	{ 2₀₀₁ \| 0 0 1/2 }
3	-x,-y,-z,+1	{ -1 \| 0 }
4	x,y,-z+1/2,+1	{ m₀₀₁ \| 0 0 1/2 }
(1/4,3/4,0) + set click here to show and hide
5	x+1/4,y+3/4,z,+1	{ 1 \| 1/4 3/4 0 }
6	-x+1/4,-y+3/4,z+1/2,+1	{ 2₀₀₁ \| 1/4 3/4 1/2 }
7	-x+1/4,-y+3/4,-z,+1	{ -1 \| 1/4 3/4 0 }
8	x+1/4,y+3/4,-z+1/2,+1	{ m₀₀₁ \| 1/4 3/4 1/2 }
(1/2,1/2,0) + set click here to show and hide
9	x+1/2,y+1/2,z,+1	{ 1 \| 1/2 1/2 0 }
10	-x+1/2,-y+1/2,z+1/2,+1	{ 2₀₀₁ \| 1/2 1/2 1/2 }
11	-x+1/2,-y+1/2,-z,+1	{ -1 \| 1/2 1/2 0 }
12	x+1/2,y+1/2,-z+1/2,+1	{ m₀₀₁ \| 1/2 1/2 1/2 }
(3/4,1/4,0) + set click here to show and hide
13	x+3/4,y+1/4,z,+1	{ 1 \| 3/4 1/4 0 }
14	-x+3/4,-y+1/4,z+1/2,+1	{ 2₀₀₁ \| 3/4 1/4 1/2 }
15	-x+3/4,-y+1/4,-z,+1	{ -1 \| 3/4 1/4 0 }
16	x+3/4,y+1/4,-z+1/2,+1	{ m₀₀₁ \| 3/4 1/4 1/2 }
(1/4,1/4,0)' + set click here to show and hide
17	x+1/4,y+1/4,z,-1	{ 1' \| 1/4 1/4 0 }
18	-x+1/4,-y+1/4,z+1/2,-1	{ 2'₀₀₁ \| 1/4 1/4 1/2 }
19	-x+1/4,-y+1/4,-z,-1	{ -1' \| 1/4 1/4 0 }
20	x+1/4,y+1/4,-z+1/2,-1	{ m'₀₀₁ \| 1/4 1/4 1/2 }
(1/2,0,0)' + set click here to show and hide
21	x+1/2,y,z,-1	{ 1' \| 1/2 0 0 }
22	-x+1/2,-y,z+1/2,-1	{ 2'₀₀₁ \| 1/2 0 1/2 }
23	-x+1/2,-y,-z,-1	{ -1' \| 1/2 0 0 }
24	x+1/2,y,-z+1/2,-1	{ m'₀₀₁ \| 1/2 0 1/2 }
(3/4,3/4,0)' + set click here to show and hide
25	x+3/4,y+3/4,z,-1	{ 1' \| 3/4 3/4 0 }
26	-x+3/4,-y+3/4,z+1/2,-1	{ 2'₀₀₁ \| 3/4 3/4 1/2 }
27	-x+3/4,-y+3/4,-z,-1	{ -1' \| 3/4 3/4 0 }
28	x+3/4,y+3/4,-z+1/2,-1	{ m'₀₀₁ \| 3/4 3/4 1/2 }
(0,1/2,0)' + set click here to show and hide
29	x,y+1/2,z,-1	{ 1' \| 0 1/2 0 }
30	-x,-y+1/2,z+1/2,-1	{ 2'₀₀₁ \| 0 1/2 1/2 }
31	-x,-y+1/2,-z,-1	{ -1' \| 0 1/2 0 }
32	x,y+1/2,-z+1/2,-1	{ m'₀₀₁ \| 0 1/2 1/2 }

[Hide]

N	(x,y,z)	Seitz notation
1	x,y,z,+1	1
2	-x,-y,z,+1	2₀₀₁
3	-x,-y,-z,+1	-1
4	x,y,-z,+1	m₀₀₁
1' + set click here to show and hide
5	x,y,z,-1	1'
6	-x,-y,z,-1	2'₀₀₁
7	-x,-y,-z,-1	-1'
8	x,y,-z,-1	m'₀₀₁

Magnetic atoms:

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Os1	Os	0.00000	0.00000	0.00000	16	m_x,m_y,m_z	1.515	0.77	0.0	1.70

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
La1	La	0.00000	0.25000	0.00000	16
La2_1	La	0.13865	0.15605	0.25000	16
La2_2	La	0.86135	0.15605	0.25000	16
O1	O	0.00000	0.46220	0.25000	16
O2_1	O	0.06190	0.09095	0.04050	32
O2_2	O	0.93810	0.09095	0.45950	32
O3_1	O	0.18485	0.01575	0.25000	16
O3_2	O	0.81515	0.01575	0.25000	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 Os1:

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	1.51500	0.77000	0.00000
2	0.00000	0.00000	0.50000	-m_x,-m_y,m_z	-1.51500	-0.77000	0.00000
(1/4,3/4,0) + set click here to show and hide
3	0.25000	0.75000	0.00000	m_x,m_y,m_z	1.51500	0.77000	0.00000
4	0.25000	0.75000	0.50000	-m_x,-m_y,m_z	-1.51500	-0.77000	0.00000
(1/2,1/2,0) + set click here to show and hide
5	0.50000	0.50000	0.00000	m_x,m_y,m_z	1.51500	0.77000	0.00000
6	0.50000	0.50000	0.50000	-m_x,-m_y,m_z	-1.51500	-0.77000	0.00000
(3/4,1/4,0) + set click here to show and hide
7	0.75000	0.25000	0.00000	m_x,m_y,m_z	1.51500	0.77000	0.00000
8	0.75000	0.25000	0.50000	-m_x,-m_y,m_z	-1.51500	-0.77000	0.00000
(1/4,1/4,0)' + set click here to show and hide
9	0.25000	0.25000	0.00000	-m_x,-m_y,-m_z	-1.51500	-0.77000	0.00000
10	0.25000	0.25000	0.50000	m_x,m_y,-m_z	1.51500	0.77000	0.00000
(1/2,0,0)' + set click here to show and hide
11	0.50000	0.00000	0.00000	-m_x,-m_y,-m_z	-1.51500	-0.77000	0.00000
12	0.50000	0.00000	0.50000	m_x,m_y,-m_z	1.51500	0.77000	0.00000
(3/4,3/4,0)' + set click here to show and hide
13	0.75000	0.75000	0.00000	-m_x,-m_y,-m_z	-1.51500	-0.77000	0.00000
14	0.75000	0.75000	0.50000	m_x,m_y,-m_z	1.51500	0.77000	0.00000
(0,1/2,0)' + set click here to show and hide
15	0.00000	0.50000	0.00000	-m_x,-m_y,-m_z	-1.51500	-0.77000	0.00000
16	0.00000	0.50000	0.50000	m_x,m_y,-m_z	1.51500	0.77000	0.00000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom La1:

Atom	x	y	z
1	0.00000	0.25000	0.00000
2	0.00000	0.75000	0.50000
(1/4,3/4,0) + set click here to show and hide
3	0.25000	0.00000	0.00000
4	0.25000	0.50000	0.50000
(1/2,1/2,0) + set click here to show and hide
5	0.50000	0.75000	0.00000
6	0.50000	0.25000	0.50000
(3/4,1/4,0) + set click here to show and hide
7	0.75000	0.50000	0.00000
8	0.75000	0.00000	0.50000
(1/4,1/4,0)' + set click here to show and hide
9	0.25000	0.50000	0.00000
10	0.25000	0.00000	0.50000
(1/2,0,0)' + set click here to show and hide
11	0.50000	0.25000	0.00000
12	0.50000	0.75000	0.50000
(3/4,3/4,0)' + set click here to show and hide
13	0.75000	0.00000	0.00000
14	0.75000	0.50000	0.50000
(0,1/2,0)' + set click here to show and hide
15	0.00000	0.75000	0.00000
16	0.00000	0.25000	0.50000

Set of atoms in the unit cell related by symmetry with the atom La2_1:

Atom	x	y	z
1	0.13865	0.15605	0.25000
2	0.86135	0.84395	0.75000
(1/4,3/4,0) + set click here to show and hide
3	0.38865	0.90605	0.25000
4	0.11135	0.59395	0.75000
(1/2,1/2,0) + set click here to show and hide
5	0.63865	0.65605	0.25000
6	0.36135	0.34395	0.75000
(3/4,1/4,0) + set click here to show and hide
7	0.88865	0.40605	0.25000
8	0.61135	0.09395	0.75000
(1/4,1/4,0)' + set click here to show and hide
9	0.38865	0.40605	0.25000
10	0.11135	0.09395	0.75000
(1/2,0,0)' + set click here to show and hide
11	0.63865	0.15605	0.25000
12	0.36135	0.84395	0.75000
(3/4,3/4,0)' + set click here to show and hide
13	0.88865	0.90605	0.25000
14	0.61135	0.59395	0.75000
(0,1/2,0)' + set click here to show and hide
15	0.13865	0.65605	0.25000
16	0.86135	0.34395	0.75000

Set of atoms in the unit cell related by symmetry with the atom La2_2:

Atom	x	y	z
1	0.86135	0.15605	0.25000
2	0.13865	0.84395	0.75000
(1/4,3/4,0) + set click here to show and hide
3	0.11135	0.90605	0.25000
4	0.38865	0.59395	0.75000
(1/2,1/2,0) + set click here to show and hide
5	0.36135	0.65605	0.25000
6	0.63865	0.34395	0.75000
(3/4,1/4,0) + set click here to show and hide
7	0.61135	0.40605	0.25000
8	0.88865	0.09395	0.75000
(1/4,1/4,0)' + set click here to show and hide
9	0.11135	0.40605	0.25000
10	0.38865	0.09395	0.75000
(1/2,0,0)' + set click here to show and hide
11	0.36135	0.15605	0.25000
12	0.63865	0.84395	0.75000
(3/4,3/4,0)' + set click here to show and hide
13	0.61135	0.90605	0.25000
14	0.88865	0.59395	0.75000
(0,1/2,0)' + set click here to show and hide
15	0.86135	0.65605	0.25000
16	0.13865	0.34395	0.75000

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

Atom	x	y	z
1	0.00000	0.46220	0.25000
2	0.00000	0.53780	0.75000
(1/4,3/4,0) + set click here to show and hide
3	0.25000	0.21220	0.25000
4	0.25000	0.28780	0.75000
(1/2,1/2,0) + set click here to show and hide
5	0.50000	0.96220	0.25000
6	0.50000	0.03780	0.75000
(3/4,1/4,0) + set click here to show and hide
7	0.75000	0.71220	0.25000
8	0.75000	0.78780	0.75000
(1/4,1/4,0)' + set click here to show and hide
9	0.25000	0.71220	0.25000
10	0.25000	0.78780	0.75000
(1/2,0,0)' + set click here to show and hide
11	0.50000	0.46220	0.25000
12	0.50000	0.53780	0.75000
(3/4,3/4,0)' + set click here to show and hide
13	0.75000	0.21220	0.25000
14	0.75000	0.28780	0.75000
(0,1/2,0)' + set click here to show and hide
15	0.00000	0.96220	0.25000
16	0.00000	0.03780	0.75000

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

Atom	x	y	z
1	0.06190	0.09095	0.04050
2	0.93810	0.90905	0.54050
3	0.93810	0.90905	0.95950
4	0.06190	0.09095	0.45950
(1/4,3/4,0) + set click here to show and hide
5	0.31190	0.84095	0.04050
6	0.18810	0.65905	0.54050
7	0.18810	0.65905	0.95950
8	0.31190	0.84095	0.45950
(1/2,1/2,0) + set click here to show and hide
9	0.56190	0.59095	0.04050
10	0.43810	0.40905	0.54050
11	0.43810	0.40905	0.95950
12	0.56190	0.59095	0.45950
(3/4,1/4,0) + set click here to show and hide
13	0.81190	0.34095	0.04050
14	0.68810	0.15905	0.54050
15	0.68810	0.15905	0.95950
16	0.81190	0.34095	0.45950
(1/4,1/4,0)' + set click here to show and hide
17	0.31190	0.34095	0.04050
18	0.18810	0.15905	0.54050
19	0.18810	0.15905	0.95950
20	0.31190	0.34095	0.45950
(1/2,0,0)' + set click here to show and hide
21	0.56190	0.09095	0.04050
22	0.43810	0.90905	0.54050
23	0.43810	0.90905	0.95950
24	0.56190	0.09095	0.45950
(3/4,3/4,0)' + set click here to show and hide
25	0.81190	0.84095	0.04050
26	0.68810	0.65905	0.54050
27	0.68810	0.65905	0.95950
28	0.81190	0.84095	0.45950
(0,1/2,0)' + set click here to show and hide
29	0.06190	0.59095	0.04050
30	0.93810	0.40905	0.54050
31	0.93810	0.40905	0.95950
32	0.06190	0.59095	0.45950

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

Atom	x	y	z
1	0.93810	0.09095	0.45950
2	0.06190	0.90905	0.95950
3	0.06190	0.90905	0.54050
4	0.93810	0.09095	0.04050
(1/4,3/4,0) + set click here to show and hide
5	0.18810	0.84095	0.45950
6	0.31190	0.65905	0.95950
7	0.31190	0.65905	0.54050
8	0.18810	0.84095	0.04050
(1/2,1/2,0) + set click here to show and hide
9	0.43810	0.59095	0.45950
10	0.56190	0.40905	0.95950
11	0.56190	0.40905	0.54050
12	0.43810	0.59095	0.04050
(3/4,1/4,0) + set click here to show and hide
13	0.68810	0.34095	0.45950
14	0.81190	0.15905	0.95950
15	0.81190	0.15905	0.54050
16	0.68810	0.34095	0.04050
(1/4,1/4,0)' + set click here to show and hide
17	0.18810	0.34095	0.45950
18	0.31190	0.15905	0.95950
19	0.31190	0.15905	0.54050
20	0.18810	0.34095	0.04050
(1/2,0,0)' + set click here to show and hide
21	0.43810	0.09095	0.45950
22	0.56190	0.90905	0.95950
23	0.56190	0.90905	0.54050
24	0.43810	0.09095	0.04050
(3/4,3/4,0)' + set click here to show and hide
25	0.68810	0.84095	0.45950
26	0.81190	0.65905	0.95950
27	0.81190	0.65905	0.54050
28	0.68810	0.84095	0.04050
(0,1/2,0)' + set click here to show and hide
29	0.93810	0.59095	0.45950
30	0.06190	0.40905	0.95950
31	0.06190	0.40905	0.54050
32	0.93810	0.59095	0.04050

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

Atom	x	y	z
1	0.18485	0.01575	0.25000
2	0.81515	0.98425	0.75000
(1/4,3/4,0) + set click here to show and hide
3	0.43485	0.76575	0.25000
4	0.06515	0.73425	0.75000
(1/2,1/2,0) + set click here to show and hide
5	0.68485	0.51575	0.25000
6	0.31515	0.48425	0.75000
(3/4,1/4,0) + set click here to show and hide
7	0.93485	0.26575	0.25000
8	0.56515	0.23425	0.75000
(1/4,1/4,0)' + set click here to show and hide
9	0.43485	0.26575	0.25000
10	0.06515	0.23425	0.75000
(1/2,0,0)' + set click here to show and hide
11	0.68485	0.01575	0.25000
12	0.31515	0.98425	0.75000
(3/4,3/4,0)' + set click here to show and hide
13	0.93485	0.76575	0.25000
14	0.56515	0.73425	0.75000
(0,1/2,0)' + set click here to show and hide
15	0.18485	0.51575	0.25000
16	0.81515	0.48425	0.75000

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

Atom	x	y	z
1	0.81515	0.01575	0.25000
2	0.18485	0.98425	0.75000
(1/4,3/4,0) + set click here to show and hide
3	0.06515	0.76575	0.25000
4	0.43485	0.73425	0.75000
(1/2,1/2,0) + set click here to show and hide
5	0.31515	0.51575	0.25000
6	0.68485	0.48425	0.75000
(3/4,1/4,0) + set click here to show and hide
7	0.56515	0.26575	0.25000
8	0.93485	0.23425	0.75000
(1/4,1/4,0)' + set click here to show and hide
9	0.06515	0.26575	0.25000
10	0.43485	0.23425	0.75000
(1/2,0,0)' + set click here to show and hide
11	0.31515	0.01575	0.25000
12	0.68485	0.98425	0.75000
(3/4,3/4,0)' + set click here to show and hide
13	0.56515	0.76575	0.25000
14	0.93485	0.73425	0.75000
(0,1/2,0)' + set click here to show and hide
15	0.81515	0.51575	0.25000
16	0.18485	0.48425	0.75000

[Hide]

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Os1	Os	0.00000	0.00000	0.00000	16	m_x,m_y,m_z	1.515	0.77	0.0	1.70

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

label	dim. small irrep	dim. full irrep	action	number of modes
mS1+	1	2	primary	3

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

La₃OsO₇ (#1.571)

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

La3OsO7 (#1.571)

La₃OsO₇ (#1.571)