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	y,x,-z+1/2,+1	{ 2₁₁₀ \| 0 0 1/2 }
3	-x,-y,-z,+1	{ -1 \| 0 }
4	-y,-x,z+1/2,+1	{ m₁₁₀ \| 0 0 1/2 }
(1/6,5/6,2/3) + set click here to show and hide
5	x+1/6,y+5/6,z+2/3,+1	{ 1 \| 1/6 5/6 2/3 }
6	y+1/6,x+5/6,-z+1/6,+1	{ 2₁₁₀ \| 1/6 5/6 1/6 }
7	-x+1/6,-y+5/6,-z+2/3,+1	{ -1 \| 1/6 5/6 2/3 }
8	-y+1/6,-x+5/6,z+1/6,+1	{ m₁₁₀ \| 1/6 5/6 1/6 }
(1/3,2/3,1/3) + set click here to show and hide
9	x+1/3,y+2/3,z+1/3,+1	{ 1 \| 1/3 2/3 1/3 }
10	y+1/3,x+2/3,-z+5/6,+1	{ 2₁₁₀ \| 1/3 2/3 5/6 }
11	-x+1/3,-y+2/3,-z+1/3,+1	{ -1 \| 1/3 2/3 1/3 }
12	-y+1/3,-x+2/3,z+5/6,+1	{ m₁₁₀ \| 1/3 2/3 5/6 }
(1/2,1/2,0) + set click here to show and hide
13	x+1/2,y+1/2,z,+1	{ 1 \| 1/2 1/2 0 }
14	y+1/2,x+1/2,-z+1/2,+1	{ 2₁₁₀ \| 1/2 1/2 1/2 }
15	-x+1/2,-y+1/2,-z,+1	{ -1 \| 1/2 1/2 0 }
16	-y+1/2,-x+1/2,z+1/2,+1	{ m₁₁₀ \| 1/2 1/2 1/2 }
(2/3,1/3,2/3) + set click here to show and hide
17	x+2/3,y+1/3,z+2/3,+1	{ 1 \| 2/3 1/3 2/3 }
18	y+2/3,x+1/3,-z+1/6,+1	{ 2₁₁₀ \| 2/3 1/3 1/6 }
19	-x+2/3,-y+1/3,-z+2/3,+1	{ -1 \| 2/3 1/3 2/3 }
20	-y+2/3,-x+1/3,z+1/6,+1	{ m₁₁₀ \| 2/3 1/3 1/6 }
(5/6,1/6,1/3) + set click here to show and hide
21	x+5/6,y+1/6,z+1/3,+1	{ 1 \| 5/6 1/6 1/3 }
22	y+5/6,x+1/6,-z+5/6,+1	{ 2₁₁₀ \| 5/6 1/6 5/6 }
23	-x+5/6,-y+1/6,-z+1/3,+1	{ -1 \| 5/6 1/6 1/3 }
24	-y+5/6,-x+1/6,z+5/6,+1	{ m₁₁₀ \| 5/6 1/6 5/6 }
(1/3,1/6,1/3)' + set click here to show and hide
25	x+1/3,y+1/6,z+1/3,-1	{ 1' \| 1/3 1/6 1/3 }
26	y+1/3,x+1/6,-z+5/6,-1	{ 2'₁₁₀ \| 1/3 1/6 5/6 }
27	-x+1/3,-y+1/6,-z+1/3,-1	{ -1' \| 1/3 1/6 1/3 }
28	-y+1/3,-x+1/6,z+5/6,-1	{ m'₁₁₀ \| 1/3 1/6 5/6 }
(1/2,0,0)' + set click here to show and hide
29	x+1/2,y,z,-1	{ 1' \| 1/2 0 0 }
30	y+1/2,x,-z+1/2,-1	{ 2'₁₁₀ \| 1/2 0 1/2 }
31	-x+1/2,-y,-z,-1	{ -1' \| 1/2 0 0 }
32	-y+1/2,-x,z+1/2,-1	{ m'₁₁₀ \| 1/2 0 1/2 }
(2/3,5/6,2/3)' + set click here to show and hide
33	x+2/3,y+5/6,z+2/3,-1	{ 1' \| 2/3 5/6 2/3 }
34	y+2/3,x+5/6,-z+1/6,-1	{ 2'₁₁₀ \| 2/3 5/6 1/6 }
35	-x+2/3,-y+5/6,-z+2/3,-1	{ -1' \| 2/3 5/6 2/3 }
36	-y+2/3,-x+5/6,z+1/6,-1	{ m'₁₁₀ \| 2/3 5/6 1/6 }
(5/6,2/3,1/3)' + set click here to show and hide
37	x+5/6,y+2/3,z+1/3,-1	{ 1' \| 5/6 2/3 1/3 }
38	y+5/6,x+2/3,-z+5/6,-1	{ 2'₁₁₀ \| 5/6 2/3 5/6 }
39	-x+5/6,-y+2/3,-z+1/3,-1	{ -1' \| 5/6 2/3 1/3 }
40	-y+5/6,-x+2/3,z+5/6,-1	{ m'₁₁₀ \| 5/6 2/3 5/6 }
(0,1/2,0)' + set click here to show and hide
41	x,y+1/2,z,-1	{ 1' \| 0 1/2 0 }
42	y,x+1/2,-z+1/2,-1	{ 2'₁₁₀ \| 0 1/2 1/2 }
43	-x,-y+1/2,-z,-1	{ -1' \| 0 1/2 0 }
44	-y,-x+1/2,z+1/2,-1	{ m'₁₁₀ \| 0 1/2 1/2 }
(1/6,1/3,2/3)' + set click here to show and hide
45	x+1/6,y+1/3,z+2/3,-1	{ 1' \| 1/6 1/3 2/3 }
46	y+1/6,x+1/3,-z+1/6,-1	{ 2'₁₁₀ \| 1/6 1/3 1/6 }
47	-x+1/6,-y+1/3,-z+2/3,-1	{ -1' \| 1/6 1/3 2/3 }
48	-y+1/6,-x+1/3,z+1/6,-1	{ m'₁₁₀ \| 1/6 1/3 1/6 }

[Hide]

N	(x,y,z)	Seitz notation
1	x,y,z,+1	1
2	y,x,-z,+1	2₁₁₀
3	-x,-y,-z,+1	-1
4	-y,-x,z,+1	m₁₁₀
1' + set click here to show and hide
5	x,y,z,-1	1'
6	y,x,-z,-1	2'₁₁₀
7	-x,-y,-z,-1	-1'
8	-y,-x,z,-1	m'₁₁₀

Magnetic atoms:

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Ir1	Ir	0.00000	0.00000	0.00000	24	m_x,m_y,m_z	-0.24	0.04	0.33	0.42

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
Ca1_1	Ca	0.31896	0.00000	0.25000	48
Ca1_2	Ca	0.68104	0.68104	0.25000	24
Ca2	Ca	0.00000	0.00000	0.25000	24
O1_1	O	0.42060	0.01425	0.10810	48
O1_2	O	0.98575	0.40635	0.10810	48
O1_3	O	0.59365	0.57940	0.10810	48

[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 Ir1:

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	-0.24000	0.04000	0.33000
2	0.00000	0.00000	0.50000	m_y,m_x,-m_z	0.04000	-0.24000	-0.33000
(1/6,5/6,2/3) + set click here to show and hide
3	0.16667	0.83333	0.66667	m_x,m_y,m_z	-0.24000	0.04000	0.33000
4	0.16667	0.83333	0.16667	m_y,m_x,-m_z	0.04000	-0.24000	-0.33000
(1/3,2/3,1/3) + set click here to show and hide
5	0.33333	0.66667	0.33333	m_x,m_y,m_z	-0.24000	0.04000	0.33000
6	0.33333	0.66667	0.83333	m_y,m_x,-m_z	0.04000	-0.24000	-0.33000
(1/2,1/2,0) + set click here to show and hide
7	0.50000	0.50000	0.00000	m_x,m_y,m_z	-0.24000	0.04000	0.33000
8	0.50000	0.50000	0.50000	m_y,m_x,-m_z	0.04000	-0.24000	-0.33000
(2/3,1/3,2/3) + set click here to show and hide
9	0.66667	0.33333	0.66667	m_x,m_y,m_z	-0.24000	0.04000	0.33000
10	0.66667	0.33333	0.16667	m_y,m_x,-m_z	0.04000	-0.24000	-0.33000
(5/6,1/6,1/3) + set click here to show and hide
11	0.83333	0.16667	0.33333	m_x,m_y,m_z	-0.24000	0.04000	0.33000
12	0.83333	0.16667	0.83333	m_y,m_x,-m_z	0.04000	-0.24000	-0.33000
(1/3,1/6,1/3)' + set click here to show and hide
13	0.33333	0.16667	0.33333	-m_x,-m_y,-m_z	0.24000	-0.04000	-0.33000
14	0.33333	0.16667	0.83333	-m_y,-m_x,m_z	-0.04000	0.24000	0.33000
(1/2,0,0)' + set click here to show and hide
15	0.50000	0.00000	0.00000	-m_x,-m_y,-m_z	0.24000	-0.04000	-0.33000
16	0.50000	0.00000	0.50000	-m_y,-m_x,m_z	-0.04000	0.24000	0.33000
(2/3,5/6,2/3)' + set click here to show and hide
17	0.66667	0.83333	0.66667	-m_x,-m_y,-m_z	0.24000	-0.04000	-0.33000
18	0.66667	0.83333	0.16667	-m_y,-m_x,m_z	-0.04000	0.24000	0.33000
(5/6,2/3,1/3)' + set click here to show and hide
19	0.83333	0.66667	0.33333	-m_x,-m_y,-m_z	0.24000	-0.04000	-0.33000
20	0.83333	0.66667	0.83333	-m_y,-m_x,m_z	-0.04000	0.24000	0.33000
(0,1/2,0)' + set click here to show and hide
21	0.00000	0.50000	0.00000	-m_x,-m_y,-m_z	0.24000	-0.04000	-0.33000
22	0.00000	0.50000	0.50000	-m_y,-m_x,m_z	-0.04000	0.24000	0.33000
(1/6,1/3,2/3)' + set click here to show and hide
23	0.16667	0.33333	0.66667	-m_x,-m_y,-m_z	0.24000	-0.04000	-0.33000
24	0.16667	0.33333	0.16667	-m_y,-m_x,m_z	-0.04000	0.24000	0.33000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom Ca1_1:

Atom	x	y	z
1	0.31896	0.00000	0.25000
2	0.00000	0.31896	0.25000
3	0.68104	0.00000	0.75000
4	0.00000	0.68104	0.75000
(1/6,5/6,2/3) + set click here to show and hide
5	0.48563	0.83333	0.91667
6	0.16667	0.15229	0.91667
7	0.84771	0.83333	0.41667
8	0.16667	0.51437	0.41667
(1/3,2/3,1/3) + set click here to show and hide
9	0.65229	0.66667	0.58333
10	0.33333	0.98563	0.58333
11	0.01437	0.66667	0.08333
12	0.33333	0.34771	0.08333
(1/2,1/2,0) + set click here to show and hide
13	0.81896	0.50000	0.25000
14	0.50000	0.81896	0.25000
15	0.18104	0.50000	0.75000
16	0.50000	0.18104	0.75000
(2/3,1/3,2/3) + set click here to show and hide
17	0.98563	0.33333	0.91667
18	0.66667	0.65229	0.91667
19	0.34771	0.33333	0.41667
20	0.66667	0.01437	0.41667
(5/6,1/6,1/3) + set click here to show and hide
21	0.15229	0.16667	0.58333
22	0.83333	0.48563	0.58333
23	0.51437	0.16667	0.08333
24	0.83333	0.84771	0.08333
(1/3,1/6,1/3)' + set click here to show and hide
25	0.65229	0.16667	0.58333
26	0.33333	0.48563	0.58333
27	0.01437	0.16667	0.08333
28	0.33333	0.84771	0.08333
(1/2,0,0)' + set click here to show and hide
29	0.81896	0.00000	0.25000
30	0.50000	0.31896	0.25000
31	0.18104	0.00000	0.75000
32	0.50000	0.68104	0.75000
(2/3,5/6,2/3)' + set click here to show and hide
33	0.98563	0.83333	0.91667
34	0.66667	0.15229	0.91667
35	0.34771	0.83333	0.41667
36	0.66667	0.51437	0.41667
(5/6,2/3,1/3)' + set click here to show and hide
37	0.15229	0.66667	0.58333
38	0.83333	0.98563	0.58333
39	0.51437	0.66667	0.08333
40	0.83333	0.34771	0.08333
(0,1/2,0)' + set click here to show and hide
41	0.31896	0.50000	0.25000
42	0.00000	0.81896	0.25000
43	0.68104	0.50000	0.75000
44	0.00000	0.18104	0.75000
(1/6,1/3,2/3)' + set click here to show and hide
45	0.48563	0.33333	0.91667
46	0.16667	0.65229	0.91667
47	0.84771	0.33333	0.41667
48	0.16667	0.01437	0.41667

Set of atoms in the unit cell related by symmetry with the atom Ca1_2:

Atom	x	y	z
1	0.68104	0.68104	0.25000
2	0.31896	0.31896	0.75000
(1/6,5/6,2/3) + set click here to show and hide
3	0.84771	0.51437	0.91667
4	0.48563	0.15229	0.41667
(1/3,2/3,1/3) + set click here to show and hide
5	0.01437	0.34771	0.58333
6	0.65229	0.98563	0.08333
(1/2,1/2,0) + set click here to show and hide
7	0.18104	0.18104	0.25000
8	0.81896	0.81896	0.75000
(2/3,1/3,2/3) + set click here to show and hide
9	0.34771	0.01437	0.91667
10	0.98563	0.65229	0.41667
(5/6,1/6,1/3) + set click here to show and hide
11	0.51437	0.84771	0.58333
12	0.15229	0.48563	0.08333
(1/3,1/6,1/3)' + set click here to show and hide
13	0.01437	0.84771	0.58333
14	0.65229	0.48563	0.08333
(1/2,0,0)' + set click here to show and hide
15	0.18104	0.68104	0.25000
16	0.81896	0.31896	0.75000
(2/3,5/6,2/3)' + set click here to show and hide
17	0.34771	0.51437	0.91667
18	0.98563	0.15229	0.41667
(5/6,2/3,1/3)' + set click here to show and hide
19	0.51437	0.34771	0.58333
20	0.15229	0.98563	0.08333
(0,1/2,0)' + set click here to show and hide
21	0.68104	0.18104	0.25000
22	0.31896	0.81896	0.75000
(1/6,1/3,2/3)' + set click here to show and hide
23	0.84771	0.01437	0.91667
24	0.48563	0.65229	0.41667

Set of atoms in the unit cell related by symmetry with the atom Ca2:

Atom	x	y	z
1	0.00000	0.00000	0.25000
2	0.00000	0.00000	0.75000
(1/6,5/6,2/3) + set click here to show and hide
3	0.16667	0.83333	0.91667
4	0.16667	0.83333	0.41667
(1/3,2/3,1/3) + set click here to show and hide
5	0.33333	0.66667	0.58333
6	0.33333	0.66667	0.08333
(1/2,1/2,0) + set click here to show and hide
7	0.50000	0.50000	0.25000
8	0.50000	0.50000	0.75000
(2/3,1/3,2/3) + set click here to show and hide
9	0.66667	0.33333	0.91667
10	0.66667	0.33333	0.41667
(5/6,1/6,1/3) + set click here to show and hide
11	0.83333	0.16667	0.58333
12	0.83333	0.16667	0.08333
(1/3,1/6,1/3)' + set click here to show and hide
13	0.33333	0.16667	0.58333
14	0.33333	0.16667	0.08333
(1/2,0,0)' + set click here to show and hide
15	0.50000	0.00000	0.25000
16	0.50000	0.00000	0.75000
(2/3,5/6,2/3)' + set click here to show and hide
17	0.66667	0.83333	0.91667
18	0.66667	0.83333	0.41667
(5/6,2/3,1/3)' + set click here to show and hide
19	0.83333	0.66667	0.58333
20	0.83333	0.66667	0.08333
(0,1/2,0)' + set click here to show and hide
21	0.00000	0.50000	0.25000
22	0.00000	0.50000	0.75000
(1/6,1/3,2/3)' + set click here to show and hide
23	0.16667	0.33333	0.91667
24	0.16667	0.33333	0.41667

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

Atom	x	y	z
1	0.42060	0.01425	0.10810
2	0.01425	0.42060	0.39190
3	0.57940	0.98575	0.89190
4	0.98575	0.57940	0.60810
(1/6,5/6,2/3) + set click here to show and hide
5	0.58727	0.84758	0.77477
6	0.18092	0.25393	0.05857
7	0.74607	0.81908	0.55857
8	0.15242	0.41273	0.27477
(1/3,2/3,1/3) + set click here to show and hide
9	0.75393	0.68092	0.44143
10	0.34758	0.08727	0.72523
11	0.91273	0.65242	0.22523
12	0.31908	0.24607	0.94143
(1/2,1/2,0) + set click here to show and hide
13	0.92060	0.51425	0.10810
14	0.51425	0.92060	0.39190
15	0.07940	0.48575	0.89190
16	0.48575	0.07940	0.60810
(2/3,1/3,2/3) + set click here to show and hide
17	0.08727	0.34758	0.77477
18	0.68092	0.75393	0.05857
19	0.24607	0.31908	0.55857
20	0.65242	0.91273	0.27477
(5/6,1/6,1/3) + set click here to show and hide
21	0.25393	0.18092	0.44143
22	0.84758	0.58727	0.72523
23	0.41273	0.15242	0.22523
24	0.81908	0.74607	0.94143
(1/3,1/6,1/3)' + set click here to show and hide
25	0.75393	0.18092	0.44143
26	0.34758	0.58727	0.72523
27	0.91273	0.15242	0.22523
28	0.31908	0.74607	0.94143
(1/2,0,0)' + set click here to show and hide
29	0.92060	0.01425	0.10810
30	0.51425	0.42060	0.39190
31	0.07940	0.98575	0.89190
32	0.48575	0.57940	0.60810
(2/3,5/6,2/3)' + set click here to show and hide
33	0.08727	0.84758	0.77477
34	0.68092	0.25393	0.05857
35	0.24607	0.81908	0.55857
36	0.65242	0.41273	0.27477
(5/6,2/3,1/3)' + set click here to show and hide
37	0.25393	0.68092	0.44143
38	0.84758	0.08727	0.72523
39	0.41273	0.65242	0.22523
40	0.81908	0.24607	0.94143
(0,1/2,0)' + set click here to show and hide
41	0.42060	0.51425	0.10810
42	0.01425	0.92060	0.39190
43	0.57940	0.48575	0.89190
44	0.98575	0.07940	0.60810
(1/6,1/3,2/3)' + set click here to show and hide
45	0.58727	0.34758	0.77477
46	0.18092	0.75393	0.05857
47	0.74607	0.31908	0.55857
48	0.15242	0.91273	0.27477

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

Atom	x	y	z
1	0.98575	0.40635	0.10810
2	0.40635	0.98575	0.39190
3	0.01425	0.59365	0.89190
4	0.59365	0.01425	0.60810
(1/6,5/6,2/3) + set click here to show and hide
5	0.15242	0.23968	0.77477
6	0.57302	0.81908	0.05857
7	0.18092	0.42698	0.55857
8	0.76032	0.84758	0.27477
(1/3,2/3,1/3) + set click here to show and hide
9	0.31908	0.07302	0.44143
10	0.73968	0.65242	0.72523
11	0.34758	0.26032	0.22523
12	0.92698	0.68092	0.94143
(1/2,1/2,0) + set click here to show and hide
13	0.48575	0.90635	0.10810
14	0.90635	0.48575	0.39190
15	0.51425	0.09365	0.89190
16	0.09365	0.51425	0.60810
(2/3,1/3,2/3) + set click here to show and hide
17	0.65242	0.73968	0.77477
18	0.07302	0.31908	0.05857
19	0.68092	0.92698	0.55857
20	0.26032	0.34758	0.27477
(5/6,1/6,1/3) + set click here to show and hide
21	0.81908	0.57302	0.44143
22	0.23968	0.15242	0.72523
23	0.84758	0.76032	0.22523
24	0.42698	0.18092	0.94143
(1/3,1/6,1/3)' + set click here to show and hide
25	0.31908	0.57302	0.44143
26	0.73968	0.15242	0.72523
27	0.34758	0.76032	0.22523
28	0.92698	0.18092	0.94143
(1/2,0,0)' + set click here to show and hide
29	0.48575	0.40635	0.10810
30	0.90635	0.98575	0.39190
31	0.51425	0.59365	0.89190
32	0.09365	0.01425	0.60810
(2/3,5/6,2/3)' + set click here to show and hide
33	0.65242	0.23968	0.77477
34	0.07302	0.81908	0.05857
35	0.68092	0.42698	0.55857
36	0.26032	0.84758	0.27477
(5/6,2/3,1/3)' + set click here to show and hide
37	0.81908	0.07302	0.44143
38	0.23968	0.65242	0.72523
39	0.84758	0.26032	0.22523
40	0.42698	0.68092	0.94143
(0,1/2,0)' + set click here to show and hide
41	0.98575	0.90635	0.10810
42	0.40635	0.48575	0.39190
43	0.01425	0.09365	0.89190
44	0.59365	0.51425	0.60810
(1/6,1/3,2/3)' + set click here to show and hide
45	0.15242	0.73968	0.77477
46	0.57302	0.31908	0.05857
47	0.18092	0.92698	0.55857
48	0.76032	0.34758	0.27477

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

Atom	x	y	z
1	0.59365	0.57940	0.10810
2	0.57940	0.59365	0.39190
3	0.40635	0.42060	0.89190
4	0.42060	0.40635	0.60810
(1/6,5/6,2/3) + set click here to show and hide
5	0.76032	0.41273	0.77477
6	0.74607	0.42698	0.05857
7	0.57302	0.25393	0.55857
8	0.58727	0.23968	0.27477
(1/3,2/3,1/3) + set click here to show and hide
9	0.92698	0.24607	0.44143
10	0.91273	0.26032	0.72523
11	0.73968	0.08727	0.22523
12	0.75393	0.07302	0.94143
(1/2,1/2,0) + set click here to show and hide
13	0.09365	0.07940	0.10810
14	0.07940	0.09365	0.39190
15	0.90635	0.92060	0.89190
16	0.92060	0.90635	0.60810
(2/3,1/3,2/3) + set click here to show and hide
17	0.26032	0.91273	0.77477
18	0.24607	0.92698	0.05857
19	0.07302	0.75393	0.55857
20	0.08727	0.73968	0.27477
(5/6,1/6,1/3) + set click here to show and hide
21	0.42698	0.74607	0.44143
22	0.41273	0.76032	0.72523
23	0.23968	0.58727	0.22523
24	0.25393	0.57302	0.94143
(1/3,1/6,1/3)' + set click here to show and hide
25	0.92698	0.74607	0.44143
26	0.91273	0.76032	0.72523
27	0.73968	0.58727	0.22523
28	0.75393	0.57302	0.94143
(1/2,0,0)' + set click here to show and hide
29	0.09365	0.57940	0.10810
30	0.07940	0.59365	0.39190
31	0.90635	0.42060	0.89190
32	0.92060	0.40635	0.60810
(2/3,5/6,2/3)' + set click here to show and hide
33	0.26032	0.41273	0.77477
34	0.24607	0.42698	0.05857
35	0.07302	0.25393	0.55857
36	0.08727	0.23968	0.27477
(5/6,2/3,1/3)' + set click here to show and hide
37	0.42698	0.24607	0.44143
38	0.41273	0.26032	0.72523
39	0.23968	0.08727	0.22523
40	0.25393	0.07302	0.94143
(0,1/2,0)' + set click here to show and hide
41	0.59365	0.07940	0.10810
42	0.57940	0.09365	0.39190
43	0.40635	0.92060	0.89190
44	0.42060	0.90635	0.60810
(1/6,1/3,2/3)' + set click here to show and hide
45	0.76032	0.91273	0.77477
46	0.74607	0.92698	0.05857
47	0.57302	0.75393	0.55857
48	0.58727	0.73968	0.27477

[Hide]

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Ir1	Ir	0.00000	0.00000	0.00000	24	m_x,m_y,m_z	-0.24	0.04	0.33	0.42

[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 Ir1:

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	-0.24000	0.04000	0.33000
2	0.00000	0.00000	0.50000	m_y,m_x,-m_z	0.04000	-0.24000	-0.33000
(1/6,5/6,2/3) + set click here to show and hide
3	0.16667	0.83333	0.66667	m_x,m_y,m_z	-0.24000	0.04000	0.33000
4	0.16667	0.83333	0.16667	m_y,m_x,-m_z	0.04000	-0.24000	-0.33000
(1/3,2/3,1/3) + set click here to show and hide
5	0.33333	0.66667	0.33333	m_x,m_y,m_z	-0.24000	0.04000	0.33000
6	0.33333	0.66667	0.83333	m_y,m_x,-m_z	0.04000	-0.24000	-0.33000
(1/2,1/2,0) + set click here to show and hide
7	0.50000	0.50000	0.00000	m_x,m_y,m_z	-0.24000	0.04000	0.33000
8	0.50000	0.50000	0.50000	m_y,m_x,-m_z	0.04000	-0.24000	-0.33000
(2/3,1/3,2/3) + set click here to show and hide
9	0.66667	0.33333	0.66667	m_x,m_y,m_z	-0.24000	0.04000	0.33000
10	0.66667	0.33333	0.16667	m_y,m_x,-m_z	0.04000	-0.24000	-0.33000
(5/6,1/6,1/3) + set click here to show and hide
11	0.83333	0.16667	0.33333	m_x,m_y,m_z	-0.24000	0.04000	0.33000
12	0.83333	0.16667	0.83333	m_y,m_x,-m_z	0.04000	-0.24000	-0.33000
(1/3,1/6,1/3)' + set click here to show and hide
13	0.33333	0.16667	0.33333	-m_x,-m_y,-m_z	0.24000	-0.04000	-0.33000
14	0.33333	0.16667	0.83333	-m_y,-m_x,m_z	-0.04000	0.24000	0.33000
(1/2,0,0)' + set click here to show and hide
15	0.50000	0.00000	0.00000	-m_x,-m_y,-m_z	0.24000	-0.04000	-0.33000
16	0.50000	0.00000	0.50000	-m_y,-m_x,m_z	-0.04000	0.24000	0.33000
(2/3,5/6,2/3)' + set click here to show and hide
17	0.66667	0.83333	0.66667	-m_x,-m_y,-m_z	0.24000	-0.04000	-0.33000
18	0.66667	0.83333	0.16667	-m_y,-m_x,m_z	-0.04000	0.24000	0.33000
(5/6,2/3,1/3)' + set click here to show and hide
19	0.83333	0.66667	0.33333	-m_x,-m_y,-m_z	0.24000	-0.04000	-0.33000
20	0.83333	0.66667	0.83333	-m_y,-m_x,m_z	-0.04000	0.24000	0.33000
(0,1/2,0)' + set click here to show and hide
21	0.00000	0.50000	0.00000	-m_x,-m_y,-m_z	0.24000	-0.04000	-0.33000
22	0.00000	0.50000	0.50000	-m_y,-m_x,m_z	-0.04000	0.24000	0.33000
(1/6,1/3,2/3)' + set click here to show and hide
23	0.16667	0.33333	0.66667	-m_x,-m_y,-m_z	0.24000	-0.04000	-0.33000
24	0.16667	0.33333	0.16667	-m_y,-m_x,m_z	-0.04000	0.24000	0.33000

[Hide]

label	dim. small irrep	dim. full irrep	action	number of modes
mF1+	1	3	primary	3

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

Ca₄IrO₆ (#1.114)

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

Ca4IrO6 (#1.114)

Ca₄IrO₆ (#1.114)