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

[Hide]

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	Occupancy	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Co1	Co	0.00000	0.00000	0.50000	1.	8	m_x,m_y,m_z	0.0	0.0	0.0	0.00
Os1	Os	0.00000	0.00000	0.00000	1.	8	m_x,m_y,m_z	1.11	-1.11	0.0	1.57

Non-magnetic atoms:

Label	Atom type	x	y	z	Occupancy	Multiplicity
Sr1	Sr	0.25000	0.00000	0.24990	1.	16
O1	O	0.00000	0.00000	0.24230	1.	16
O2_1	O	0.10280	0.14030	0.00000	0.5	16
O2_2	O	0.89720	0.14030	0.00000	0.5	16
O3_1	O	0.13875	0.39845	0.00000	0.5	16
O3_2	O	0.86125	0.39845	0.00000	0.5	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 Co1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.00000	0.50000	m_x,m_y,m_z	0.00000	0.00000	0.00000
(1/4,3/4,1/2) + set click here to show and hide
2	0.25000	0.75000	0.00000	m_x,m_y,m_z	0.00000	0.00000	0.00000
(1/2,1/2,0) + set click here to show and hide
3	0.50000	0.50000	0.50000	m_x,m_y,m_z	0.00000	0.00000	0.00000
(3/4,1/4,1/2) + set click here to show and hide
4	0.75000	0.25000	0.00000	m_x,m_y,m_z	0.00000	0.00000	0.00000
(3/4,3/4,1/2)' + set click here to show and hide
5	0.75000	0.75000	0.00000	-m_x,-m_y,-m_z	0.00000	0.00000	0.00000
(0,1/2,0)' + set click here to show and hide
6	0.00000	0.50000	0.50000	-m_x,-m_y,-m_z	0.00000	0.00000	0.00000
(1/4,1/4,1/2)' + set click here to show and hide
7	0.25000	0.25000	0.00000	-m_x,-m_y,-m_z	0.00000	0.00000	0.00000
(1/2,0,0)' + set click here to show and hide
8	0.50000	0.00000	0.50000	-m_x,-m_y,-m_z	0.00000	0.00000	0.00000

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	1.11000	-1.11000	0.00000
(1/4,3/4,1/2) + set click here to show and hide
2	0.25000	0.75000	0.50000	m_x,m_y,m_z	1.11000	-1.11000	0.00000
(1/2,1/2,0) + set click here to show and hide
3	0.50000	0.50000	0.00000	m_x,m_y,m_z	1.11000	-1.11000	0.00000
(3/4,1/4,1/2) + set click here to show and hide
4	0.75000	0.25000	0.50000	m_x,m_y,m_z	1.11000	-1.11000	0.00000
(3/4,3/4,1/2)' + set click here to show and hide
5	0.75000	0.75000	0.50000	-m_x,-m_y,-m_z	-1.11000	1.11000	0.00000
(0,1/2,0)' + set click here to show and hide
6	0.00000	0.50000	0.00000	-m_x,-m_y,-m_z	-1.11000	1.11000	0.00000
(1/4,1/4,1/2)' + set click here to show and hide
7	0.25000	0.25000	0.50000	-m_x,-m_y,-m_z	-1.11000	1.11000	0.00000
(1/2,0,0)' + set click here to show and hide
8	0.50000	0.00000	0.00000	-m_x,-m_y,-m_z	-1.11000	1.11000	0.00000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom Sr1:

Atom	x	y	z
1	0.25000	0.00000	0.24990
2	0.75000	0.00000	0.75010
(1/4,3/4,1/2) + set click here to show and hide
3	0.50000	0.75000	0.74990
4	0.00000	0.75000	0.25010
(1/2,1/2,0) + set click here to show and hide
5	0.75000	0.50000	0.24990
6	0.25000	0.50000	0.75010
(3/4,1/4,1/2) + set click here to show and hide
7	0.00000	0.25000	0.74990
8	0.50000	0.25000	0.25010
(3/4,3/4,1/2)' + set click here to show and hide
9	0.00000	0.75000	0.74990
10	0.50000	0.75000	0.25010
(0,1/2,0)' + set click here to show and hide
11	0.25000	0.50000	0.24990
12	0.75000	0.50000	0.75010
(1/4,1/4,1/2)' + set click here to show and hide
13	0.50000	0.25000	0.74990
14	0.00000	0.25000	0.25010
(1/2,0,0)' + set click here to show and hide
15	0.75000	0.00000	0.24990
16	0.25000	0.00000	0.75010

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

Atom	x	y	z
1	0.00000	0.00000	0.24230
2	0.00000	0.00000	0.75770
(1/4,3/4,1/2) + set click here to show and hide
3	0.25000	0.75000	0.74230
4	0.25000	0.75000	0.25770
(1/2,1/2,0) + set click here to show and hide
5	0.50000	0.50000	0.24230
6	0.50000	0.50000	0.75770
(3/4,1/4,1/2) + set click here to show and hide
7	0.75000	0.25000	0.74230
8	0.75000	0.25000	0.25770
(3/4,3/4,1/2)' + set click here to show and hide
9	0.75000	0.75000	0.74230
10	0.75000	0.75000	0.25770
(0,1/2,0)' + set click here to show and hide
11	0.00000	0.50000	0.24230
12	0.00000	0.50000	0.75770
(1/4,1/4,1/2)' + set click here to show and hide
13	0.25000	0.25000	0.74230
14	0.25000	0.25000	0.25770
(1/2,0,0)' + set click here to show and hide
15	0.50000	0.00000	0.24230
16	0.50000	0.00000	0.75770

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

Atom	x	y	z
1	0.10280	0.14030	0.00000
2	0.89720	0.85970	0.00000
(1/4,3/4,1/2) + set click here to show and hide
3	0.35280	0.89030	0.50000
4	0.14720	0.60970	0.50000
(1/2,1/2,0) + set click here to show and hide
5	0.60280	0.64030	0.00000
6	0.39720	0.35970	0.00000
(3/4,1/4,1/2) + set click here to show and hide
7	0.85280	0.39030	0.50000
8	0.64720	0.10970	0.50000
(3/4,3/4,1/2)' + set click here to show and hide
9	0.85280	0.89030	0.50000
10	0.64720	0.60970	0.50000
(0,1/2,0)' + set click here to show and hide
11	0.10280	0.64030	0.00000
12	0.89720	0.35970	0.00000
(1/4,1/4,1/2)' + set click here to show and hide
13	0.35280	0.39030	0.50000
14	0.14720	0.10970	0.50000
(1/2,0,0)' + set click here to show and hide
15	0.60280	0.14030	0.00000
16	0.39720	0.85970	0.00000

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

Atom	x	y	z
1	0.89720	0.14030	0.00000
2	0.10280	0.85970	0.00000
(1/4,3/4,1/2) + set click here to show and hide
3	0.14720	0.89030	0.50000
4	0.35280	0.60970	0.50000
(1/2,1/2,0) + set click here to show and hide
5	0.39720	0.64030	0.00000
6	0.60280	0.35970	0.00000
(3/4,1/4,1/2) + set click here to show and hide
7	0.64720	0.39030	0.50000
8	0.85280	0.10970	0.50000
(3/4,3/4,1/2)' + set click here to show and hide
9	0.64720	0.89030	0.50000
10	0.85280	0.60970	0.50000
(0,1/2,0)' + set click here to show and hide
11	0.89720	0.64030	0.00000
12	0.10280	0.35970	0.00000
(1/4,1/4,1/2)' + set click here to show and hide
13	0.14720	0.39030	0.50000
14	0.35280	0.10970	0.50000
(1/2,0,0)' + set click here to show and hide
15	0.39720	0.14030	0.00000
16	0.60280	0.85970	0.00000

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

Atom	x	y	z
1	0.13875	0.39845	0.00000
2	0.86125	0.60155	0.00000
(1/4,3/4,1/2) + set click here to show and hide
3	0.38875	0.14845	0.50000
4	0.11125	0.35155	0.50000
(1/2,1/2,0) + set click here to show and hide
5	0.63875	0.89845	0.00000
6	0.36125	0.10155	0.00000
(3/4,1/4,1/2) + set click here to show and hide
7	0.88875	0.64845	0.50000
8	0.61125	0.85155	0.50000
(3/4,3/4,1/2)' + set click here to show and hide
9	0.88875	0.14845	0.50000
10	0.61125	0.35155	0.50000
(0,1/2,0)' + set click here to show and hide
11	0.13875	0.89845	0.00000
12	0.86125	0.10155	0.00000
(1/4,1/4,1/2)' + set click here to show and hide
13	0.38875	0.64845	0.50000
14	0.11125	0.85155	0.50000
(1/2,0,0)' + set click here to show and hide
15	0.63875	0.39845	0.00000
16	0.36125	0.60155	0.00000

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

Atom	x	y	z
1	0.86125	0.39845	0.00000
2	0.13875	0.60155	0.00000
(1/4,3/4,1/2) + set click here to show and hide
3	0.11125	0.14845	0.50000
4	0.38875	0.35155	0.50000
(1/2,1/2,0) + set click here to show and hide
5	0.36125	0.89845	0.00000
6	0.63875	0.10155	0.00000
(3/4,1/4,1/2) + set click here to show and hide
7	0.61125	0.64845	0.50000
8	0.88875	0.85155	0.50000
(3/4,3/4,1/2)' + set click here to show and hide
9	0.61125	0.14845	0.50000
10	0.88875	0.35155	0.50000
(0,1/2,0)' + set click here to show and hide
11	0.86125	0.89845	0.00000
12	0.13875	0.10155	0.00000
(1/4,1/4,1/2)' + set click here to show and hide
13	0.11125	0.64845	0.50000
14	0.38875	0.85155	0.50000
(1/2,0,0)' + set click here to show and hide
15	0.36125	0.39845	0.00000
16	0.63875	0.60155	0.00000

[Hide]

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Co1	Co	0.00000	0.00000	0.50000	8	m_x,m_y,m_z	0.0	0.0	0.0	0.00
Os1	Os	0.00000	0.00000	0.00000	8	m_x,m_y,m_z	1.11	-1.11	0.0	1.57

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

label	dim. small irrep	dim. full irrep	action	number of modes
mV1+	1	2	primary	6

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

Sr₂CoOsO₆ (#1.243)

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

Sr2CoOsO6 (#1.243)

Sr₂CoOsO₆ (#1.243)