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+1/2,y,-z+1/4,+1	{ 2₀₁₀ \| 1/2 0 1/4 }
3	-x+1/4,-y+1/2,-z,+1	{ -1 \| 1/4 1/2 0 }
4	x+1/4,-y+1/2,z+1/4,+1	{ m₀₁₀ \| 1/4 1/2 1/4 }
(0,1/2,1/2) + set click here to show and hide
5	x,y+1/2,z+1/2,+1	{ 1 \| 0 1/2 1/2 }
6	-x+1/2,y+1/2,-z+3/4,+1	{ 2₀₁₀ \| 1/2 1/2 3/4 }
7	-x+1/4,-y,-z+1/2,+1	{ -1 \| 1/4 0 1/2 }
8	x+1/4,-y,z+3/4,+1	{ m₀₁₀ \| 1/4 0 3/4 }
(1/2,0,1/2) + set click here to show and hide
9	x+1/2,y,z+1/2,+1	{ 1 \| 1/2 0 1/2 }
10	-x,y,-z+3/4,+1	{ 2₀₁₀ \| 0 0 3/4 }
11	-x+3/4,-y+1/2,-z+1/2,+1	{ -1 \| 3/4 1/2 1/2 }
12	x+3/4,-y+1/2,z+3/4,+1	{ m₀₁₀ \| 3/4 1/2 3/4 }
(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	-x,y+1/2,-z+1/4,+1	{ 2₀₁₀ \| 0 1/2 1/4 }
15	-x+3/4,-y,-z,+1	{ -1 \| 3/4 0 0 }
16	x+3/4,-y,z+1/4,+1	{ m₀₁₀ \| 3/4 0 1/4 }
(1/2,0,0)' + set click here to show and hide
17	x+1/2,y,z,-1	{ 1' \| 1/2 0 0 }
18	-x,y,-z+1/4,-1	{ 2'₀₁₀ \| 0 0 1/4 }
19	-x+3/4,-y+1/2,-z,-1	{ -1' \| 3/4 1/2 0 }
20	x+3/4,-y+1/2,z+1/4,-1	{ m'₀₁₀ \| 3/4 1/2 1/4 }
(1/2,1/2,1/2)' + set click here to show and hide
21	x+1/2,y+1/2,z+1/2,-1	{ 1' \| 1/2 1/2 1/2 }
22	-x,y+1/2,-z+3/4,-1	{ 2'₀₁₀ \| 0 1/2 3/4 }
23	-x+3/4,-y,-z+1/2,-1	{ -1' \| 3/4 0 1/2 }
24	x+3/4,-y,z+3/4,-1	{ m'₀₁₀ \| 3/4 0 3/4 }
(0,0,1/2)' + set click here to show and hide
25	x,y,z+1/2,-1	{ 1' \| 0 0 1/2 }
26	-x+1/2,y,-z+3/4,-1	{ 2'₀₁₀ \| 1/2 0 3/4 }
27	-x+1/4,-y+1/2,-z+1/2,-1	{ -1' \| 1/4 1/2 1/2 }
28	x+1/4,-y+1/2,z+3/4,-1	{ m'₀₁₀ \| 1/4 1/2 3/4 }
(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+1/2,y+1/2,-z+1/4,-1	{ 2'₀₁₀ \| 1/2 1/2 1/4 }
31	-x+1/4,-y,-z,-1	{ -1' \| 1/4 0 0 }
32	x+1/4,-y,z+1/4,-1	{ m'₀₁₀ \| 1/4 0 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\|
Mn1	Mn2+	0.12500	0.34265	0.12500	32	m_x,m_y,m_z	3.6	0.0	2.7	4.46

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
W1_1	W	0	0.089985	0.125	16
W1_2	W	0.25	0.089985	0.125	16
O1_1	O	0.052437	0.051015	0.471895	32
O1_2	O	0.302437	0.051015	0.471895	32
O2_1	O	0.062602	0.187345	0.19714	32
O2_2	O	0.312602	0.187345	0.19714	32

[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 Mn1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.12500	0.34265	0.12500	m_x,m_y,m_z	3.60000	0.00000	2.70000
2	0.37500	0.34265	0.12500	-m_x,m_y,-m_z	-3.60000	0.00000	-2.70000
3	0.12500	0.15735	0.87500	m_x,m_y,m_z	3.60000	0.00000	2.70000
4	0.37500	0.15735	0.37500	-m_x,m_y,-m_z	-3.60000	0.00000	-2.70000
(0,1/2,1/2) + set click here to show and hide
5	0.12500	0.84265	0.62500	m_x,m_y,m_z	3.60000	0.00000	2.70000
6	0.37500	0.84265	0.62500	-m_x,m_y,-m_z	-3.60000	0.00000	-2.70000
7	0.12500	0.65735	0.37500	m_x,m_y,m_z	3.60000	0.00000	2.70000
8	0.37500	0.65735	0.87500	-m_x,m_y,-m_z	-3.60000	0.00000	-2.70000
(1/2,0,1/2) + set click here to show and hide
9	0.62500	0.34265	0.62500	m_x,m_y,m_z	3.60000	0.00000	2.70000
10	0.87500	0.34265	0.62500	-m_x,m_y,-m_z	-3.60000	0.00000	-2.70000
11	0.62500	0.15735	0.37500	m_x,m_y,m_z	3.60000	0.00000	2.70000
12	0.87500	0.15735	0.87500	-m_x,m_y,-m_z	-3.60000	0.00000	-2.70000
(1/2,1/2,0) + set click here to show and hide
13	0.62500	0.84265	0.12500	m_x,m_y,m_z	3.60000	0.00000	2.70000
14	0.87500	0.84265	0.12500	-m_x,m_y,-m_z	-3.60000	0.00000	-2.70000
15	0.62500	0.65735	0.87500	m_x,m_y,m_z	3.60000	0.00000	2.70000
16	0.87500	0.65735	0.37500	-m_x,m_y,-m_z	-3.60000	0.00000	-2.70000
(1/2,0,0)' + set click here to show and hide
17	0.62500	0.34265	0.12500	-m_x,-m_y,-m_z	-3.60000	0.00000	-2.70000
18	0.87500	0.34265	0.12500	m_x,-m_y,m_z	3.60000	0.00000	2.70000
19	0.62500	0.15735	0.87500	-m_x,-m_y,-m_z	-3.60000	0.00000	-2.70000
20	0.87500	0.15735	0.37500	m_x,-m_y,m_z	3.60000	0.00000	2.70000
(1/2,1/2,1/2)' + set click here to show and hide
21	0.62500	0.84265	0.62500	-m_x,-m_y,-m_z	-3.60000	0.00000	-2.70000
22	0.87500	0.84265	0.62500	m_x,-m_y,m_z	3.60000	0.00000	2.70000
23	0.62500	0.65735	0.37500	-m_x,-m_y,-m_z	-3.60000	0.00000	-2.70000
24	0.87500	0.65735	0.87500	m_x,-m_y,m_z	3.60000	0.00000	2.70000
(0,0,1/2)' + set click here to show and hide
25	0.12500	0.34265	0.62500	-m_x,-m_y,-m_z	-3.60000	0.00000	-2.70000
26	0.37500	0.34265	0.62500	m_x,-m_y,m_z	3.60000	0.00000	2.70000
27	0.12500	0.15735	0.37500	-m_x,-m_y,-m_z	-3.60000	0.00000	-2.70000
28	0.37500	0.15735	0.87500	m_x,-m_y,m_z	3.60000	0.00000	2.70000
(0,1/2,0)' + set click here to show and hide
29	0.12500	0.84265	0.12500	-m_x,-m_y,-m_z	-3.60000	0.00000	-2.70000
30	0.37500	0.84265	0.12500	m_x,-m_y,m_z	3.60000	0.00000	2.70000
31	0.12500	0.65735	0.87500	-m_x,-m_y,-m_z	-3.60000	0.00000	-2.70000
32	0.37500	0.65735	0.37500	m_x,-m_y,m_z	3.60000	0.00000	2.70000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom W1_1:

Atom	x	y	z
1	0.00000	0.08998	0.12500
2	0.25000	0.41002	0.87500
(0,1/2,1/2) + set click here to show and hide
3	0.00000	0.58998	0.62500
4	0.25000	0.91002	0.37500
(1/2,0,1/2) + set click here to show and hide
5	0.50000	0.08998	0.62500
6	0.75000	0.41002	0.37500
(1/2,1/2,0) + set click here to show and hide
7	0.50000	0.58998	0.12500
8	0.75000	0.91002	0.87500
(1/2,0,0)' + set click here to show and hide
9	0.50000	0.08998	0.12500
10	0.75000	0.41002	0.87500
(1/2,1/2,1/2)' + set click here to show and hide
11	0.50000	0.58998	0.62500
12	0.75000	0.91002	0.37500
(0,0,1/2)' + set click here to show and hide
13	0.00000	0.08998	0.62500
14	0.25000	0.41002	0.37500
(0,1/2,0)' + set click here to show and hide
15	0.00000	0.58998	0.12500
16	0.25000	0.91002	0.87500

Set of atoms in the unit cell related by symmetry with the atom W1_2:

Atom	x	y	z
1	0.25000	0.08998	0.12500
2	0.00000	0.41002	0.87500
(0,1/2,1/2) + set click here to show and hide
3	0.25000	0.58998	0.62500
4	0.00000	0.91002	0.37500
(1/2,0,1/2) + set click here to show and hide
5	0.75000	0.08998	0.62500
6	0.50000	0.41002	0.37500
(1/2,1/2,0) + set click here to show and hide
7	0.75000	0.58998	0.12500
8	0.50000	0.91002	0.87500
(1/2,0,0)' + set click here to show and hide
9	0.75000	0.08998	0.12500
10	0.50000	0.41002	0.87500
(1/2,1/2,1/2)' + set click here to show and hide
11	0.75000	0.58998	0.62500
12	0.50000	0.91002	0.37500
(0,0,1/2)' + set click here to show and hide
13	0.25000	0.08998	0.62500
14	0.00000	0.41002	0.37500
(0,1/2,0)' + set click here to show and hide
15	0.25000	0.58998	0.12500
16	0.00000	0.91002	0.87500

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

Atom	x	y	z
1	0.05244	0.05101	0.47190
2	0.44756	0.05101	0.77811
3	0.19756	0.44899	0.52811
4	0.30244	0.44899	0.72189
(0,1/2,1/2) + set click here to show and hide
5	0.05244	0.55102	0.97189
6	0.44756	0.55102	0.27811
7	0.19756	0.94898	0.02811
8	0.30244	0.94898	0.22189
(1/2,0,1/2) + set click here to show and hide
9	0.55244	0.05101	0.97189
10	0.94756	0.05101	0.27811
11	0.69756	0.44899	0.02811
12	0.80244	0.44899	0.22189
(1/2,1/2,0) + set click here to show and hide
13	0.55244	0.55102	0.47190
14	0.94756	0.55102	0.77811
15	0.69756	0.94898	0.52811
16	0.80244	0.94898	0.72189
(1/2,0,0)' + set click here to show and hide
17	0.55244	0.05101	0.47190
18	0.94756	0.05101	0.77811
19	0.69756	0.44899	0.52811
20	0.80244	0.44899	0.72189
(1/2,1/2,1/2)' + set click here to show and hide
21	0.55244	0.55102	0.97189
22	0.94756	0.55102	0.27811
23	0.69756	0.94898	0.02811
24	0.80244	0.94898	0.22189
(0,0,1/2)' + set click here to show and hide
25	0.05244	0.05101	0.97189
26	0.44756	0.05101	0.27811
27	0.19756	0.44899	0.02811
28	0.30244	0.44899	0.22189
(0,1/2,0)' + set click here to show and hide
29	0.05244	0.55102	0.47190
30	0.44756	0.55102	0.77811
31	0.19756	0.94898	0.52811
32	0.30244	0.94898	0.72189

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

Atom	x	y	z
1	0.30244	0.05101	0.47190
2	0.19756	0.05101	0.77811
3	0.94756	0.44899	0.52811
4	0.55244	0.44899	0.72189
(0,1/2,1/2) + set click here to show and hide
5	0.30244	0.55102	0.97189
6	0.19756	0.55102	0.27811
7	0.94756	0.94898	0.02811
8	0.55244	0.94898	0.22189
(1/2,0,1/2) + set click here to show and hide
9	0.80244	0.05101	0.97189
10	0.69756	0.05101	0.27811
11	0.44756	0.44899	0.02811
12	0.05244	0.44899	0.22189
(1/2,1/2,0) + set click here to show and hide
13	0.80244	0.55102	0.47190
14	0.69756	0.55102	0.77811
15	0.44756	0.94898	0.52811
16	0.05244	0.94898	0.72189
(1/2,0,0)' + set click here to show and hide
17	0.80244	0.05101	0.47190
18	0.69756	0.05101	0.77811
19	0.44756	0.44899	0.52811
20	0.05244	0.44899	0.72189
(1/2,1/2,1/2)' + set click here to show and hide
21	0.80244	0.55102	0.97189
22	0.69756	0.55102	0.27811
23	0.44756	0.94898	0.02811
24	0.05244	0.94898	0.22189
(0,0,1/2)' + set click here to show and hide
25	0.30244	0.05101	0.97189
26	0.19756	0.05101	0.27811
27	0.94756	0.44899	0.02811
28	0.55244	0.44899	0.22189
(0,1/2,0)' + set click here to show and hide
29	0.30244	0.55102	0.47190
30	0.19756	0.55102	0.77811
31	0.94756	0.94898	0.52811
32	0.55244	0.94898	0.72189

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

Atom	x	y	z
1	0.06260	0.18735	0.19714
2	0.43740	0.18735	0.05286
3	0.18740	0.31266	0.80286
4	0.31260	0.31266	0.44714
(0,1/2,1/2) + set click here to show and hide
5	0.06260	0.68734	0.69714
6	0.43740	0.68734	0.55286
7	0.18740	0.81266	0.30286
8	0.31260	0.81266	0.94714
(1/2,0,1/2) + set click here to show and hide
9	0.56260	0.18735	0.69714
10	0.93740	0.18735	0.55286
11	0.68740	0.31266	0.30286
12	0.81260	0.31266	0.94714
(1/2,1/2,0) + set click here to show and hide
13	0.56260	0.68734	0.19714
14	0.93740	0.68734	0.05286
15	0.68740	0.81266	0.80286
16	0.81260	0.81266	0.44714
(1/2,0,0)' + set click here to show and hide
17	0.56260	0.18735	0.19714
18	0.93740	0.18735	0.05286
19	0.68740	0.31266	0.80286
20	0.81260	0.31266	0.44714
(1/2,1/2,1/2)' + set click here to show and hide
21	0.56260	0.68734	0.69714
22	0.93740	0.68734	0.55286
23	0.68740	0.81266	0.30286
24	0.81260	0.81266	0.94714
(0,0,1/2)' + set click here to show and hide
25	0.06260	0.18735	0.69714
26	0.43740	0.18735	0.55286
27	0.18740	0.31266	0.30286
28	0.31260	0.31266	0.94714
(0,1/2,0)' + set click here to show and hide
29	0.06260	0.68734	0.19714
30	0.43740	0.68734	0.05286
31	0.18740	0.81266	0.80286
32	0.31260	0.81266	0.44714

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

Atom	x	y	z
1	0.31260	0.18735	0.19714
2	0.18740	0.18735	0.05286
3	0.93740	0.31266	0.80286
4	0.56260	0.31266	0.44714
(0,1/2,1/2) + set click here to show and hide
5	0.31260	0.68734	0.69714
6	0.18740	0.68734	0.55286
7	0.93740	0.81266	0.30286
8	0.56260	0.81266	0.94714
(1/2,0,1/2) + set click here to show and hide
9	0.81260	0.18735	0.69714
10	0.68740	0.18735	0.55286
11	0.43740	0.31266	0.30286
12	0.06260	0.31266	0.94714
(1/2,1/2,0) + set click here to show and hide
13	0.81260	0.68734	0.19714
14	0.68740	0.68734	0.05286
15	0.43740	0.81266	0.80286
16	0.06260	0.81266	0.44714
(1/2,0,0)' + set click here to show and hide
17	0.81260	0.18735	0.19714
18	0.68740	0.18735	0.05286
19	0.43740	0.31266	0.80286
20	0.06260	0.31266	0.44714
(1/2,1/2,1/2)' + set click here to show and hide
21	0.81260	0.68734	0.69714
22	0.68740	0.68734	0.55286
23	0.43740	0.81266	0.30286
24	0.06260	0.81266	0.94714
(0,0,1/2)' + set click here to show and hide
25	0.31260	0.18735	0.69714
26	0.18740	0.18735	0.55286
27	0.93740	0.31266	0.30286
28	0.56260	0.31266	0.94714
(0,1/2,0)' + set click here to show and hide
29	0.31260	0.68734	0.19714
30	0.18740	0.68734	0.05286
31	0.93740	0.81266	0.80286
32	0.56260	0.81266	0.44714

[Hide]

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Mn1	Mn2+	0.12500	0.34265	0.12500	32	m_x,m_y,m_z	3.6	0.0	2.7	4.46

[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 Mn1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.12500	0.34265	0.12500	m_x,m_y,m_z	3.60000	0.00000	2.70000
2	0.37500	0.34265	0.12500	-m_x,m_y,-m_z	-3.60000	0.00000	-2.70000
3	0.12500	0.15735	0.87500	m_x,m_y,m_z	3.60000	0.00000	2.70000
4	0.37500	0.15735	0.37500	-m_x,m_y,-m_z	-3.60000	0.00000	-2.70000
(0,1/2,1/2) + set click here to show and hide
5	0.12500	0.84265	0.62500	m_x,m_y,m_z	3.60000	0.00000	2.70000
6	0.37500	0.84265	0.62500	-m_x,m_y,-m_z	-3.60000	0.00000	-2.70000
7	0.12500	0.65735	0.37500	m_x,m_y,m_z	3.60000	0.00000	2.70000
8	0.37500	0.65735	0.87500	-m_x,m_y,-m_z	-3.60000	0.00000	-2.70000
(1/2,0,1/2) + set click here to show and hide
9	0.62500	0.34265	0.62500	m_x,m_y,m_z	3.60000	0.00000	2.70000
10	0.87500	0.34265	0.62500	-m_x,m_y,-m_z	-3.60000	0.00000	-2.70000
11	0.62500	0.15735	0.37500	m_x,m_y,m_z	3.60000	0.00000	2.70000
12	0.87500	0.15735	0.87500	-m_x,m_y,-m_z	-3.60000	0.00000	-2.70000
(1/2,1/2,0) + set click here to show and hide
13	0.62500	0.84265	0.12500	m_x,m_y,m_z	3.60000	0.00000	2.70000
14	0.87500	0.84265	0.12500	-m_x,m_y,-m_z	-3.60000	0.00000	-2.70000
15	0.62500	0.65735	0.87500	m_x,m_y,m_z	3.60000	0.00000	2.70000
16	0.87500	0.65735	0.37500	-m_x,m_y,-m_z	-3.60000	0.00000	-2.70000
(1/2,0,0)' + set click here to show and hide
17	0.62500	0.34265	0.12500	-m_x,-m_y,-m_z	-3.60000	0.00000	-2.70000
18	0.87500	0.34265	0.12500	m_x,-m_y,m_z	3.60000	0.00000	2.70000
19	0.62500	0.15735	0.87500	-m_x,-m_y,-m_z	-3.60000	0.00000	-2.70000
20	0.87500	0.15735	0.37500	m_x,-m_y,m_z	3.60000	0.00000	2.70000
(1/2,1/2,1/2)' + set click here to show and hide
21	0.62500	0.84265	0.62500	-m_x,-m_y,-m_z	-3.60000	0.00000	-2.70000
22	0.87500	0.84265	0.62500	m_x,-m_y,m_z	3.60000	0.00000	2.70000
23	0.62500	0.65735	0.37500	-m_x,-m_y,-m_z	-3.60000	0.00000	-2.70000
24	0.87500	0.65735	0.87500	m_x,-m_y,m_z	3.60000	0.00000	2.70000
(0,0,1/2)' + set click here to show and hide
25	0.12500	0.34265	0.62500	-m_x,-m_y,-m_z	-3.60000	0.00000	-2.70000
26	0.37500	0.34265	0.62500	m_x,-m_y,m_z	3.60000	0.00000	2.70000
27	0.12500	0.15735	0.37500	-m_x,-m_y,-m_z	-3.60000	0.00000	-2.70000
28	0.37500	0.15735	0.87500	m_x,-m_y,m_z	3.60000	0.00000	2.70000
(0,1/2,0)' + set click here to show and hide
29	0.12500	0.84265	0.12500	-m_x,-m_y,-m_z	-3.60000	0.00000	-2.70000
30	0.37500	0.84265	0.12500	m_x,-m_y,m_z	3.60000	0.00000	2.70000
31	0.12500	0.65735	0.87500	-m_x,-m_y,-m_z	-3.60000	0.00000	-2.70000
32	0.37500	0.65735	0.37500	m_x,-m_y,m_z	3.60000	0.00000	2.70000

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label	dim. full irrep	dim. small irrep	direction	action
mG1	2	1	special	primary

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

MnWO₄ (#1.61)

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

MnWO4 (#1.61)

MnWO₄ (#1.61)