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 }
(1/2,0,1/2) + set click here to show and hide
3	x+1/2,y,z+1/2,+1	{ 1 \| 1/2 0 1/2 }
4	-x+1/2,-y,-z+1/2,+1	{ -1 \| 1/2 0 1/2 }
(1/3,1/3,2/3) + set click here to show and hide
5	x+1/3,y+1/3,z+2/3,+1	{ 1 \| 1/3 1/3 2/3 }
6	-x+1/3,-y+1/3,-z+2/3,+1	{ -1 \| 1/3 1/3 2/3 }
(5/6,1/3,1/6) + set click here to show and hide
7	x+5/6,y+1/3,z+1/6,+1	{ 1 \| 5/6 1/3 1/6 }
8	-x+5/6,-y+1/3,-z+1/6,+1	{ -1 \| 5/6 1/3 1/6 }
(1/6,2/3,5/6) + set click here to show and hide
9	x+1/6,y+2/3,z+5/6,+1	{ 1 \| 1/6 2/3 5/6 }
10	-x+1/6,-y+2/3,-z+5/6,+1	{ -1 \| 1/6 2/3 5/6 }
(2/3,2/3,1/3) + set click here to show and hide
11	x+2/3,y+2/3,z+1/3,+1	{ 1 \| 2/3 2/3 1/3 }
12	-x+2/3,-y+2/3,-z+1/3,+1	{ -1 \| 2/3 2/3 1/3 }
(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+1/2,-y,-z,-1	{ -1' \| 1/2 0 0 }
(0,0,1/2)' + set click here to show and hide
15	x,y,z+1/2,-1	{ 1' \| 0 0 1/2 }
16	-x,-y,-z+1/2,-1	{ -1' \| 0 0 1/2 }
(1/3,1/3,1/6)' + set click here to show and hide
17	x+1/3,y+1/3,z+1/6,-1	{ 1' \| 1/3 1/3 1/6 }
18	-x+1/3,-y+1/3,-z+1/6,-1	{ -1' \| 1/3 1/3 1/6 }
(1/6,2/3,1/3)' + set click here to show and hide
19	x+1/6,y+2/3,z+1/3,-1	{ 1' \| 1/6 2/3 1/3 }
20	-x+1/6,-y+2/3,-z+1/3,-1	{ -1' \| 1/6 2/3 1/3 }
(5/6,1/3,2/3)' + set click here to show and hide
21	x+5/6,y+1/3,z+2/3,-1	{ 1' \| 5/6 1/3 2/3 }
22	-x+5/6,-y+1/3,-z+2/3,-1	{ -1' \| 5/6 1/3 2/3 }
(2/3,2/3,5/6)' + set click here to show and hide
23	x+2/3,y+2/3,z+5/6,-1	{ 1' \| 2/3 2/3 5/6 }
24	-x+2/3,-y+2/3,-z+5/6,-1	{ -1' \| 2/3 2/3 5/6 }

[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	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Co2	Co	0.00000	0.00000	0.07930	24	m_x,m_y,m_z	0.596	0.0	3.526	3.58

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
K1	K	0.00000	0.00000	0.14715	24
As1	As	0.00000	0.00000	0.27930	24
O1_1	O	0.01000	0.34300	0.06100	24
O1_2	O	0.82850	0.67700	0.06100	24
O1_3	O	0.16150	0.98000	0.06100	24
O2	O	0.00000	0.00000	0.31010	24

[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 Co2:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.00000	0.07930	m_x,m_y,m_z	0.59600	0.00000	3.52600
2	0.00000	0.00000	0.92070	m_x,m_y,m_z	0.59600	0.00000	3.52600
(1/2,0,1/2) + set click here to show and hide
3	0.50000	0.00000	0.57930	m_x,m_y,m_z	0.59600	0.00000	3.52600
4	0.50000	0.00000	0.42070	m_x,m_y,m_z	0.59600	0.00000	3.52600
(1/3,1/3,2/3) + set click here to show and hide
5	0.33333	0.33333	0.74597	m_x,m_y,m_z	0.59600	0.00000	3.52600
6	0.33333	0.33333	0.58737	m_x,m_y,m_z	0.59600	0.00000	3.52600
(5/6,1/3,1/6) + set click here to show and hide
7	0.83333	0.33333	0.24597	m_x,m_y,m_z	0.59600	0.00000	3.52600
8	0.83333	0.33333	0.08737	m_x,m_y,m_z	0.59600	0.00000	3.52600
(1/6,2/3,5/6) + set click here to show and hide
9	0.16667	0.66667	0.91263	m_x,m_y,m_z	0.59600	0.00000	3.52600
10	0.16667	0.66667	0.75403	m_x,m_y,m_z	0.59600	0.00000	3.52600
(2/3,2/3,1/3) + set click here to show and hide
11	0.66667	0.66667	0.41263	m_x,m_y,m_z	0.59600	0.00000	3.52600
12	0.66667	0.66667	0.25403	m_x,m_y,m_z	0.59600	0.00000	3.52600
(1/2,0,0)' + set click here to show and hide
13	0.50000	0.00000	0.07930	-m_x,-m_y,-m_z	-0.59600	0.00000	-3.52600
14	0.50000	0.00000	0.92070	-m_x,-m_y,-m_z	-0.59600	0.00000	-3.52600
(0,0,1/2)' + set click here to show and hide
15	0.00000	0.00000	0.57930	-m_x,-m_y,-m_z	-0.59600	0.00000	-3.52600
16	0.00000	0.00000	0.42070	-m_x,-m_y,-m_z	-0.59600	0.00000	-3.52600
(1/3,1/3,1/6)' + set click here to show and hide
17	0.33333	0.33333	0.24597	-m_x,-m_y,-m_z	-0.59600	0.00000	-3.52600
18	0.33333	0.33333	0.08737	-m_x,-m_y,-m_z	-0.59600	0.00000	-3.52600
(1/6,2/3,1/3)' + set click here to show and hide
19	0.16667	0.66667	0.41263	-m_x,-m_y,-m_z	-0.59600	0.00000	-3.52600
20	0.16667	0.66667	0.25403	-m_x,-m_y,-m_z	-0.59600	0.00000	-3.52600
(5/6,1/3,2/3)' + set click here to show and hide
21	0.83333	0.33333	0.74597	-m_x,-m_y,-m_z	-0.59600	0.00000	-3.52600
22	0.83333	0.33333	0.58737	-m_x,-m_y,-m_z	-0.59600	0.00000	-3.52600
(2/3,2/3,5/6)' + set click here to show and hide
23	0.66667	0.66667	0.91263	-m_x,-m_y,-m_z	-0.59600	0.00000	-3.52600
24	0.66667	0.66667	0.75403	-m_x,-m_y,-m_z	-0.59600	0.00000	-3.52600

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom K1:

Atom	x	y	z
1	0.00000	0.00000	0.14715
2	0.00000	0.00000	0.85285
(1/2,0,1/2) + set click here to show and hide
3	0.50000	0.00000	0.64715
4	0.50000	0.00000	0.35285
(1/3,1/3,2/3) + set click here to show and hide
5	0.33333	0.33333	0.81382
6	0.33333	0.33333	0.51952
(5/6,1/3,1/6) + set click here to show and hide
7	0.83333	0.33333	0.31382
8	0.83333	0.33333	0.01952
(1/6,2/3,5/6) + set click here to show and hide
9	0.16667	0.66667	0.98048
10	0.16667	0.66667	0.68618
(2/3,2/3,1/3) + set click here to show and hide
11	0.66667	0.66667	0.48048
12	0.66667	0.66667	0.18618
(1/2,0,0)' + set click here to show and hide
13	0.50000	0.00000	0.14715
14	0.50000	0.00000	0.85285
(0,0,1/2)' + set click here to show and hide
15	0.00000	0.00000	0.64715
16	0.00000	0.00000	0.35285
(1/3,1/3,1/6)' + set click here to show and hide
17	0.33333	0.33333	0.31382
18	0.33333	0.33333	0.01952
(1/6,2/3,1/3)' + set click here to show and hide
19	0.16667	0.66667	0.48048
20	0.16667	0.66667	0.18618
(5/6,1/3,2/3)' + set click here to show and hide
21	0.83333	0.33333	0.81382
22	0.83333	0.33333	0.51952
(2/3,2/3,5/6)' + set click here to show and hide
23	0.66667	0.66667	0.98048
24	0.66667	0.66667	0.68618

Set of atoms in the unit cell related by symmetry with the atom As1:

Atom	x	y	z
1	0.00000	0.00000	0.27930
2	0.00000	0.00000	0.72070
(1/2,0,1/2) + set click here to show and hide
3	0.50000	0.00000	0.77930
4	0.50000	0.00000	0.22070
(1/3,1/3,2/3) + set click here to show and hide
5	0.33333	0.33333	0.94597
6	0.33333	0.33333	0.38737
(5/6,1/3,1/6) + set click here to show and hide
7	0.83333	0.33333	0.44597
8	0.83333	0.33333	0.88737
(1/6,2/3,5/6) + set click here to show and hide
9	0.16667	0.66667	0.11263
10	0.16667	0.66667	0.55403
(2/3,2/3,1/3) + set click here to show and hide
11	0.66667	0.66667	0.61263
12	0.66667	0.66667	0.05403
(1/2,0,0)' + set click here to show and hide
13	0.50000	0.00000	0.27930
14	0.50000	0.00000	0.72070
(0,0,1/2)' + set click here to show and hide
15	0.00000	0.00000	0.77930
16	0.00000	0.00000	0.22070
(1/3,1/3,1/6)' + set click here to show and hide
17	0.33333	0.33333	0.44597
18	0.33333	0.33333	0.88737
(1/6,2/3,1/3)' + set click here to show and hide
19	0.16667	0.66667	0.61263
20	0.16667	0.66667	0.05403
(5/6,1/3,2/3)' + set click here to show and hide
21	0.83333	0.33333	0.94597
22	0.83333	0.33333	0.38737
(2/3,2/3,5/6)' + set click here to show and hide
23	0.66667	0.66667	0.11263
24	0.66667	0.66667	0.55403

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

Atom	x	y	z
1	0.01000	0.34300	0.06100
2	0.99000	0.65700	0.93900
(1/2,0,1/2) + set click here to show and hide
3	0.51000	0.34300	0.56100
4	0.49000	0.65700	0.43900
(1/3,1/3,2/3) + set click here to show and hide
5	0.34333	0.67633	0.72767
6	0.32333	0.99033	0.60567
(5/6,1/3,1/6) + set click here to show and hide
7	0.84333	0.67633	0.22767
8	0.82333	0.99033	0.10567
(1/6,2/3,5/6) + set click here to show and hide
9	0.17667	0.00967	0.89433
10	0.15667	0.32367	0.77233
(2/3,2/3,1/3) + set click here to show and hide
11	0.67667	0.00967	0.39433
12	0.65667	0.32367	0.27233
(1/2,0,0)' + set click here to show and hide
13	0.51000	0.34300	0.06100
14	0.49000	0.65700	0.93900
(0,0,1/2)' + set click here to show and hide
15	0.01000	0.34300	0.56100
16	0.99000	0.65700	0.43900
(1/3,1/3,1/6)' + set click here to show and hide
17	0.34333	0.67633	0.22767
18	0.32333	0.99033	0.10567
(1/6,2/3,1/3)' + set click here to show and hide
19	0.17667	0.00967	0.39433
20	0.15667	0.32367	0.27233
(5/6,1/3,2/3)' + set click here to show and hide
21	0.84333	0.67633	0.72767
22	0.82333	0.99033	0.60567
(2/3,2/3,5/6)' + set click here to show and hide
23	0.67667	0.00967	0.89433
24	0.65667	0.32367	0.77233

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

Atom	x	y	z
1	0.82850	0.67700	0.06100
2	0.17150	0.32300	0.93900
(1/2,0,1/2) + set click here to show and hide
3	0.32850	0.67700	0.56100
4	0.67150	0.32300	0.43900
(1/3,1/3,2/3) + set click here to show and hide
5	0.16183	0.01033	0.72767
6	0.50483	0.65633	0.60567
(5/6,1/3,1/6) + set click here to show and hide
7	0.66183	0.01033	0.22767
8	0.00483	0.65633	0.10567
(1/6,2/3,5/6) + set click here to show and hide
9	0.99517	0.34367	0.89433
10	0.33817	0.98967	0.77233
(2/3,2/3,1/3) + set click here to show and hide
11	0.49517	0.34367	0.39433
12	0.83817	0.98967	0.27233
(1/2,0,0)' + set click here to show and hide
13	0.32850	0.67700	0.06100
14	0.67150	0.32300	0.93900
(0,0,1/2)' + set click here to show and hide
15	0.82850	0.67700	0.56100
16	0.17150	0.32300	0.43900
(1/3,1/3,1/6)' + set click here to show and hide
17	0.16183	0.01033	0.22767
18	0.50483	0.65633	0.10567
(1/6,2/3,1/3)' + set click here to show and hide
19	0.99517	0.34367	0.39433
20	0.33817	0.98967	0.27233
(5/6,1/3,2/3)' + set click here to show and hide
21	0.66183	0.01033	0.72767
22	0.00483	0.65633	0.60567
(2/3,2/3,5/6)' + set click here to show and hide
23	0.49517	0.34367	0.89433
24	0.83817	0.98967	0.77233

Set of atoms in the unit cell related by symmetry with the atom O1_3:

Atom	x	y	z
1	0.16150	0.98000	0.06100
2	0.83850	0.02000	0.93900
(1/2,0,1/2) + set click here to show and hide
3	0.66150	0.98000	0.56100
4	0.33850	0.02000	0.43900
(1/3,1/3,2/3) + set click here to show and hide
5	0.49483	0.31333	0.72767
6	0.17183	0.35333	0.60567
(5/6,1/3,1/6) + set click here to show and hide
7	0.99483	0.31333	0.22767
8	0.67183	0.35333	0.10567
(1/6,2/3,5/6) + set click here to show and hide
9	0.32817	0.64667	0.89433
10	0.00517	0.68667	0.77233
(2/3,2/3,1/3) + set click here to show and hide
11	0.82817	0.64667	0.39433
12	0.50517	0.68667	0.27233
(1/2,0,0)' + set click here to show and hide
13	0.66150	0.98000	0.06100
14	0.33850	0.02000	0.93900
(0,0,1/2)' + set click here to show and hide
15	0.16150	0.98000	0.56100
16	0.83850	0.02000	0.43900
(1/3,1/3,1/6)' + set click here to show and hide
17	0.49483	0.31333	0.22767
18	0.17183	0.35333	0.10567
(1/6,2/3,1/3)' + set click here to show and hide
19	0.32817	0.64667	0.39433
20	0.00517	0.68667	0.27233
(5/6,1/3,2/3)' + set click here to show and hide
21	0.99483	0.31333	0.72767
22	0.67183	0.35333	0.60567
(2/3,2/3,5/6)' + set click here to show and hide
23	0.82817	0.64667	0.89433
24	0.50517	0.68667	0.77233

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

Atom	x	y	z
1	0.00000	0.00000	0.31010
2	0.00000	0.00000	0.68990
(1/2,0,1/2) + set click here to show and hide
3	0.50000	0.00000	0.81010
4	0.50000	0.00000	0.18990
(1/3,1/3,2/3) + set click here to show and hide
5	0.33333	0.33333	0.97677
6	0.33333	0.33333	0.35657
(5/6,1/3,1/6) + set click here to show and hide
7	0.83333	0.33333	0.47677
8	0.83333	0.33333	0.85657
(1/6,2/3,5/6) + set click here to show and hide
9	0.16667	0.66667	0.14343
10	0.16667	0.66667	0.52323
(2/3,2/3,1/3) + set click here to show and hide
11	0.66667	0.66667	0.64343
12	0.66667	0.66667	0.02323
(1/2,0,0)' + set click here to show and hide
13	0.50000	0.00000	0.31010
14	0.50000	0.00000	0.68990
(0,0,1/2)' + set click here to show and hide
15	0.00000	0.00000	0.81010
16	0.00000	0.00000	0.18990
(1/3,1/3,1/6)' + set click here to show and hide
17	0.33333	0.33333	0.47677
18	0.33333	0.33333	0.85657
(1/6,2/3,1/3)' + set click here to show and hide
19	0.16667	0.66667	0.64343
20	0.16667	0.66667	0.02323
(5/6,1/3,2/3)' + set click here to show and hide
21	0.83333	0.33333	0.97677
22	0.83333	0.33333	0.35657
(2/3,2/3,5/6)' + set click here to show and hide
23	0.66667	0.66667	0.14343
24	0.66667	0.66667	0.52323

[Hide]

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Co2	Co	0.00000	0.00000	0.07930	24	m_x,m_y,m_z	0.596	0.0	3.526	3.58

[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:

Set of atoms in the unit cell related by symmetry with the magnetic atom Co2:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.00000	0.07930	m_x,m_y,m_z	0.59600	0.00000	3.52600
2	0.00000	0.00000	0.92070	m_x,m_y,m_z	0.59600	0.00000	3.52600
(1/2,0,1/2) + set click here to show and hide
3	0.50000	0.00000	0.57930	m_x,m_y,m_z	0.59600	0.00000	3.52600
4	0.50000	0.00000	0.42070	m_x,m_y,m_z	0.59600	0.00000	3.52600
(1/3,1/3,2/3) + set click here to show and hide
5	0.33333	0.33333	0.74597	m_x,m_y,m_z	0.59600	0.00000	3.52600
6	0.33333	0.33333	0.58737	m_x,m_y,m_z	0.59600	0.00000	3.52600
(5/6,1/3,1/6) + set click here to show and hide
7	0.83333	0.33333	0.24597	m_x,m_y,m_z	0.59600	0.00000	3.52600
8	0.83333	0.33333	0.08737	m_x,m_y,m_z	0.59600	0.00000	3.52600
(1/6,2/3,5/6) + set click here to show and hide
9	0.16667	0.66667	0.91263	m_x,m_y,m_z	0.59600	0.00000	3.52600
10	0.16667	0.66667	0.75403	m_x,m_y,m_z	0.59600	0.00000	3.52600
(2/3,2/3,1/3) + set click here to show and hide
11	0.66667	0.66667	0.41263	m_x,m_y,m_z	0.59600	0.00000	3.52600
12	0.66667	0.66667	0.25403	m_x,m_y,m_z	0.59600	0.00000	3.52600
(1/2,0,0)' + set click here to show and hide
13	0.50000	0.00000	0.07930	-m_x,-m_y,-m_z	-0.59600	0.00000	-3.52600
14	0.50000	0.00000	0.92070	-m_x,-m_y,-m_z	-0.59600	0.00000	-3.52600
(0,0,1/2)' + set click here to show and hide
15	0.00000	0.00000	0.57930	-m_x,-m_y,-m_z	-0.59600	0.00000	-3.52600
16	0.00000	0.00000	0.42070	-m_x,-m_y,-m_z	-0.59600	0.00000	-3.52600
(1/3,1/3,1/6)' + set click here to show and hide
17	0.33333	0.33333	0.24597	-m_x,-m_y,-m_z	-0.59600	0.00000	-3.52600
18	0.33333	0.33333	0.08737	-m_x,-m_y,-m_z	-0.59600	0.00000	-3.52600
(1/6,2/3,1/3)' + set click here to show and hide
19	0.16667	0.66667	0.41263	-m_x,-m_y,-m_z	-0.59600	0.00000	-3.52600
20	0.16667	0.66667	0.25403	-m_x,-m_y,-m_z	-0.59600	0.00000	-3.52600
(5/6,1/3,2/3)' + set click here to show and hide
21	0.83333	0.33333	0.74597	-m_x,-m_y,-m_z	-0.59600	0.00000	-3.52600
22	0.83333	0.33333	0.58737	-m_x,-m_y,-m_z	-0.59600	0.00000	-3.52600
(2/3,2/3,5/6)' + set click here to show and hide
23	0.66667	0.66667	0.91263	-m_x,-m_y,-m_z	-0.59600	0.00000	-3.52600
24	0.66667	0.66667	0.75403	-m_x,-m_y,-m_z	-0.59600	0.00000	-3.52600

[Hide]

label	dim. small irrep	dim. full irrep	action	number of modes
mL1+	1	3	primary	3

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

KCoAsO₄ (#1.861)

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

KCoAsO4 (#1.861)

KCoAsO₄ (#1.861)