MAGNDATA - Collection of Magnetic Structures

N	(x,y,z)	Seitz notation
1	x,y,z,+1	{ 1 \| 0 }
2	x+1/2,y,-z,+1	{ m₀₀₁ \| 1/2 0 0 }
(1/2,1/2,1/2) + set click here to show and hide
3	x+1/2,y+1/2,z+1/2,+1	{ 1 \| 1/2 1/2 1/2 }
4	x,y+1/2,-z+1/2,+1	{ m₀₀₁ \| 0 1/2 1/2 }
(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+1/2,-1	{ m'₀₀₁ \| 1/2 1/2 1/2 }
(1/2,0,0)' + set click here to show and hide
7	x+1/2,y,z,-1	{ 1' \| 1/2 0 0 }
8	x,y,-z,-1	{ m'₀₀₁ \| 0 }

N	(x,y,z)	Seitz notation
1	x,y,z,+1	1
2	x,y,-z,+1	m₀₀₁
1' + set click here to show and hide
3	x,y,z,-1	1'
4	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\|
Fe1_1	Fe	0.0000	0.0000	0.0000	4	m_x,m_y,0	-2.7(2)	-1.9(2)	0.0	3.30
Fe1_2	Fe	0.5000	0.5000	0.0000	4	m_x,m_y,0	-2.7(2)	-1.9(2)	0.0	3.30
Fe1_3	Fe	0.2500	0.2500	0.0000	4	m_x,m_y,0	2.7(2)	-1.9(2)	0.0	3.30
Fe1_4	Fe	0.7500	0.7500	0.0000	4	m_x,m_y,0	2.7(2)	-1.9(2)	0.0	3.30
Fe2_1	Fe	0.1300	0.0450	0.2500	8	m_x,m_y,m_z	1.54(9)	0.3(2)	3.10(4)	3.47
Fe2_2	Fe	0.3800	0.2050	0.7500	8	m_x,m_y,m_z	-1.54(9)	-0.3(2)	-3.10(4)	3.47
Fe2_3	Fe	0.1201	0.2950	0.7500	8	m_x,m_y,m_z	-1.54(9)	-0.3(2)	-3.10(4)	3.47
Fe2_4	Fe	0.8701	0.9550	0.2500	8	m_x,m_y,m_z	1.54(9)	0.3(2)	3.10(4)	3.47

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
Sr1_1	Sr	0.0447	0.1744	0.0000	4
Sr1_2	Sr	0.9554	0.8257	0.0000	4
Sr1_3	Sr	0.2054	0.4244	0.0000	4
Sr1_4	Sr	0.2947	0.0757	0.0000	4
Sr1_5	Sr	0.0447	0.1744	0.5000	4
Sr1_6	Sr	0.9554	0.8257	0.5000	4
Sr1_7	Sr	0.2054	0.4244	0.5000	4
Sr1_8	Sr	0.2947	0.0757	0.5000	4
Se1_1	Se	0.2002	0.1675	0.2500	8
Se1_2	Se	0.7999	0.8325	0.2500	8
Se1_3	Se	0.0499	0.4175	0.2500	8
Se1_4	Se	0.4502	0.0825	0.2500	8
O1_1	O	0.0000	0.2500	0.2500	8
O1_2	O	0.2500	0.0000	0.2500	8
O2_1	O	0.1159	0.0430	0.0000	4
O2_2	O	0.8842	0.9570	0.0000	4
O2_3	O	0.1342	0.2930	0.0000	4
O2_4	O	0.3659	0.2070	0.0000	4
O2_5	O	0.1159	0.0430	0.5000	4
O2_6	O	0.8842	0.9570	0.5000	4
O2_7	O	0.1342	0.2930	0.5000	4
O2_8	O	0.3659	0.2070	0.5000	4

[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 Fe1_1:

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,0	-2.70000	-1.90000	0.00000
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2	0.50000	0.50000	0.50000	m_x,m_y,0	-2.70000	-1.90000	0.00000
(0,1/2,1/2)' + set click here to show and hide
3	0.00000	0.50000	0.50000	-m_x,-m_y,0	2.70000	1.90000	0.00000
(1/2,0,0)' + set click here to show and hide
4	0.50000	0.00000	0.00000	-m_x,-m_y,0	2.70000	1.90000	0.00000

Set of atoms in the unit cell related by symmetry with the magnetic atom Fe1_2:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.50000	0.50000	0.00000	m_x,m_y,0	-2.70000	-1.90000	0.00000
(1/2,1/2,1/2) + set click here to show and hide
2	0.00000	0.00000	0.50000	m_x,m_y,0	-2.70000	-1.90000	0.00000
(0,1/2,1/2)' + set click here to show and hide
3	0.50000	0.00000	0.50000	-m_x,-m_y,0	2.70000	1.90000	0.00000
(1/2,0,0)' + set click here to show and hide
4	0.00000	0.50000	0.00000	-m_x,-m_y,0	2.70000	1.90000	0.00000

Set of atoms in the unit cell related by symmetry with the magnetic atom Fe1_3:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.25000	0.25000	0.00000	m_x,m_y,0	2.70000	-1.90000	0.00000
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2	0.75000	0.75000	0.50000	m_x,m_y,0	2.70000	-1.90000	0.00000
(0,1/2,1/2)' + set click here to show and hide
3	0.25000	0.75000	0.50000	-m_x,-m_y,0	-2.70000	1.90000	0.00000
(1/2,0,0)' + set click here to show and hide
4	0.75000	0.25000	0.00000	-m_x,-m_y,0	-2.70000	1.90000	0.00000

Set of atoms in the unit cell related by symmetry with the magnetic atom Fe1_4:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.75000	0.75000	0.00000	m_x,m_y,0	2.70000	-1.90000	0.00000
(1/2,1/2,1/2) + set click here to show and hide
2	0.25000	0.25000	0.50000	m_x,m_y,0	2.70000	-1.90000	0.00000
(0,1/2,1/2)' + set click here to show and hide
3	0.75000	0.25000	0.50000	-m_x,-m_y,0	-2.70000	1.90000	0.00000
(1/2,0,0)' + set click here to show and hide
4	0.25000	0.75000	0.00000	-m_x,-m_y,0	-2.70000	1.90000	0.00000

Set of atoms in the unit cell related by symmetry with the magnetic atom Fe2_1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.13000	0.04500	0.25000	m_x,m_y,m_z	1.54000	0.30000	3.10000
2	0.63000	0.04500	0.75000	-m_x,-m_y,m_z	-1.54000	-0.30000	3.10000
(1/2,1/2,1/2) + set click here to show and hide
3	0.63000	0.54500	0.75000	m_x,m_y,m_z	1.54000	0.30000	3.10000
4	0.13000	0.54500	0.25000	-m_x,-m_y,m_z	-1.54000	-0.30000	3.10000
(0,1/2,1/2)' + set click here to show and hide
5	0.13000	0.54500	0.75000	-m_x,-m_y,-m_z	-1.54000	-0.30000	-3.10000
6	0.63000	0.54500	0.25000	m_x,m_y,-m_z	1.54000	0.30000	-3.10000
(1/2,0,0)' + set click here to show and hide
7	0.63000	0.04500	0.25000	-m_x,-m_y,-m_z	-1.54000	-0.30000	-3.10000
8	0.13000	0.04500	0.75000	m_x,m_y,-m_z	1.54000	0.30000	-3.10000

Set of atoms in the unit cell related by symmetry with the magnetic atom Fe2_2:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.38000	0.20500	0.75000	m_x,m_y,m_z	-1.54000	-0.30000	-3.10000
2	0.88000	0.20500	0.25000	-m_x,-m_y,m_z	1.54000	0.30000	-3.10000
(1/2,1/2,1/2) + set click here to show and hide
3	0.88000	0.70500	0.25000	m_x,m_y,m_z	-1.54000	-0.30000	-3.10000
4	0.38000	0.70500	0.75000	-m_x,-m_y,m_z	1.54000	0.30000	-3.10000
(0,1/2,1/2)' + set click here to show and hide
5	0.38000	0.70500	0.25000	-m_x,-m_y,-m_z	1.54000	0.30000	3.10000
6	0.88000	0.70500	0.75000	m_x,m_y,-m_z	-1.54000	-0.30000	3.10000
(1/2,0,0)' + set click here to show and hide
7	0.88000	0.20500	0.75000	-m_x,-m_y,-m_z	1.54000	0.30000	3.10000
8	0.38000	0.20500	0.25000	m_x,m_y,-m_z	-1.54000	-0.30000	3.10000

Set of atoms in the unit cell related by symmetry with the magnetic atom Fe2_3:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.12010	0.29500	0.75000	m_x,m_y,m_z	-1.54000	-0.30000	-3.10000
2	0.62010	0.29500	0.25000	-m_x,-m_y,m_z	1.54000	0.30000	-3.10000
(1/2,1/2,1/2) + set click here to show and hide
3	0.62010	0.79500	0.25000	m_x,m_y,m_z	-1.54000	-0.30000	-3.10000
4	0.12010	0.79500	0.75000	-m_x,-m_y,m_z	1.54000	0.30000	-3.10000
(0,1/2,1/2)' + set click here to show and hide
5	0.12010	0.79500	0.25000	-m_x,-m_y,-m_z	1.54000	0.30000	3.10000
6	0.62010	0.79500	0.75000	m_x,m_y,-m_z	-1.54000	-0.30000	3.10000
(1/2,0,0)' + set click here to show and hide
7	0.62010	0.29500	0.75000	-m_x,-m_y,-m_z	1.54000	0.30000	3.10000
8	0.12010	0.29500	0.25000	m_x,m_y,-m_z	-1.54000	-0.30000	3.10000

Set of atoms in the unit cell related by symmetry with the magnetic atom Fe2_4:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.87010	0.95500	0.25000	m_x,m_y,m_z	1.54000	0.30000	3.10000
2	0.37010	0.95500	0.75000	-m_x,-m_y,m_z	-1.54000	-0.30000	3.10000
(1/2,1/2,1/2) + set click here to show and hide
3	0.37010	0.45500	0.75000	m_x,m_y,m_z	1.54000	0.30000	3.10000
4	0.87010	0.45500	0.25000	-m_x,-m_y,m_z	-1.54000	-0.30000	3.10000
(0,1/2,1/2)' + set click here to show and hide
5	0.87010	0.45500	0.75000	-m_x,-m_y,-m_z	-1.54000	-0.30000	-3.10000
6	0.37010	0.45500	0.25000	m_x,m_y,-m_z	1.54000	0.30000	-3.10000
(1/2,0,0)' + set click here to show and hide
7	0.37010	0.95500	0.25000	-m_x,-m_y,-m_z	-1.54000	-0.30000	-3.10000
8	0.87010	0.95500	0.75000	m_x,m_y,-m_z	1.54000	0.30000	-3.10000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom Sr1_1:

Atom	x	y	z
1	0.04470	0.17440	0.00000
(1/2,1/2,1/2) + set click here to show and hide
2	0.54470	0.67440	0.50000
(0,1/2,1/2)' + set click here to show and hide
3	0.04470	0.67440	0.50000
(1/2,0,0)' + set click here to show and hide
4	0.54470	0.17440	0.00000

Set of atoms in the unit cell related by symmetry with the atom Sr1_2:

Atom	x	y	z
1	0.95540	0.82570	0.00000
(1/2,1/2,1/2) + set click here to show and hide
2	0.45540	0.32570	0.50000
(0,1/2,1/2)' + set click here to show and hide
3	0.95540	0.32570	0.50000
(1/2,0,0)' + set click here to show and hide
4	0.45540	0.82570	0.00000

Set of atoms in the unit cell related by symmetry with the atom Sr1_3:

Atom	x	y	z
1	0.20540	0.42440	0.00000
(1/2,1/2,1/2) + set click here to show and hide
2	0.70540	0.92440	0.50000
(0,1/2,1/2)' + set click here to show and hide
3	0.20540	0.92440	0.50000
(1/2,0,0)' + set click here to show and hide
4	0.70540	0.42440	0.00000

Set of atoms in the unit cell related by symmetry with the atom Sr1_4:

Atom	x	y	z
1	0.29470	0.07570	0.00000
(1/2,1/2,1/2) + set click here to show and hide
2	0.79470	0.57570	0.50000
(0,1/2,1/2)' + set click here to show and hide
3	0.29470	0.57570	0.50000
(1/2,0,0)' + set click here to show and hide
4	0.79470	0.07570	0.00000

Set of atoms in the unit cell related by symmetry with the atom Sr1_5:

Atom	x	y	z
1	0.04470	0.17440	0.50000
(1/2,1/2,1/2) + set click here to show and hide
2	0.54470	0.67440	0.00000
(0,1/2,1/2)' + set click here to show and hide
3	0.04470	0.67440	0.00000
(1/2,0,0)' + set click here to show and hide
4	0.54470	0.17440	0.50000

Set of atoms in the unit cell related by symmetry with the atom Sr1_6:

Atom	x	y	z
1	0.95540	0.82570	0.50000
(1/2,1/2,1/2) + set click here to show and hide
2	0.45540	0.32570	0.00000
(0,1/2,1/2)' + set click here to show and hide
3	0.95540	0.32570	0.00000
(1/2,0,0)' + set click here to show and hide
4	0.45540	0.82570	0.50000

Set of atoms in the unit cell related by symmetry with the atom Sr1_7:

Atom	x	y	z
1	0.20540	0.42440	0.50000
(1/2,1/2,1/2) + set click here to show and hide
2	0.70540	0.92440	0.00000
(0,1/2,1/2)' + set click here to show and hide
3	0.20540	0.92440	0.00000
(1/2,0,0)' + set click here to show and hide
4	0.70540	0.42440	0.50000

Set of atoms in the unit cell related by symmetry with the atom Sr1_8:

Atom	x	y	z
1	0.29470	0.07570	0.50000
(1/2,1/2,1/2) + set click here to show and hide
2	0.79470	0.57570	0.00000
(0,1/2,1/2)' + set click here to show and hide
3	0.29470	0.57570	0.00000
(1/2,0,0)' + set click here to show and hide
4	0.79470	0.07570	0.50000

Set of atoms in the unit cell related by symmetry with the atom Se1_1:

Atom	x	y	z
1	0.20020	0.16750	0.25000
2	0.70020	0.16750	0.75000
(1/2,1/2,1/2) + set click here to show and hide
3	0.70020	0.66750	0.75000
4	0.20020	0.66750	0.25000
(0,1/2,1/2)' + set click here to show and hide
5	0.20020	0.66750	0.75000
6	0.70020	0.66750	0.25000
(1/2,0,0)' + set click here to show and hide
7	0.70020	0.16750	0.25000
8	0.20020	0.16750	0.75000

Set of atoms in the unit cell related by symmetry with the atom Se1_2:

Atom	x	y	z
1	0.79990	0.83250	0.25000
2	0.29990	0.83250	0.75000
(1/2,1/2,1/2) + set click here to show and hide
3	0.29990	0.33250	0.75000
4	0.79990	0.33250	0.25000
(0,1/2,1/2)' + set click here to show and hide
5	0.79990	0.33250	0.75000
6	0.29990	0.33250	0.25000
(1/2,0,0)' + set click here to show and hide
7	0.29990	0.83250	0.25000
8	0.79990	0.83250	0.75000

Set of atoms in the unit cell related by symmetry with the atom Se1_3:

Atom	x	y	z
1	0.04990	0.41750	0.25000
2	0.54990	0.41750	0.75000
(1/2,1/2,1/2) + set click here to show and hide
3	0.54990	0.91750	0.75000
4	0.04990	0.91750	0.25000
(0,1/2,1/2)' + set click here to show and hide
5	0.04990	0.91750	0.75000
6	0.54990	0.91750	0.25000
(1/2,0,0)' + set click here to show and hide
7	0.54990	0.41750	0.25000
8	0.04990	0.41750	0.75000

Set of atoms in the unit cell related by symmetry with the atom Se1_4:

Atom	x	y	z
1	0.45020	0.08250	0.25000
2	0.95020	0.08250	0.75000
(1/2,1/2,1/2) + set click here to show and hide
3	0.95020	0.58250	0.75000
4	0.45020	0.58250	0.25000
(0,1/2,1/2)' + set click here to show and hide
5	0.45020	0.58250	0.75000
6	0.95020	0.58250	0.25000
(1/2,0,0)' + set click here to show and hide
7	0.95020	0.08250	0.25000
8	0.45020	0.08250	0.75000

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

Atom	x	y	z
1	0.00000	0.25000	0.25000
2	0.50000	0.25000	0.75000
(1/2,1/2,1/2) + set click here to show and hide
3	0.50000	0.75000	0.75000
4	0.00000	0.75000	0.25000
(0,1/2,1/2)' + set click here to show and hide
5	0.00000	0.75000	0.75000
6	0.50000	0.75000	0.25000
(1/2,0,0)' + set click here to show and hide
7	0.50000	0.25000	0.25000
8	0.00000	0.25000	0.75000

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

Atom	x	y	z
1	0.25000	0.00000	0.25000
2	0.75000	0.00000	0.75000
(1/2,1/2,1/2) + set click here to show and hide
3	0.75000	0.50000	0.75000
4	0.25000	0.50000	0.25000
(0,1/2,1/2)' + set click here to show and hide
5	0.25000	0.50000	0.75000
6	0.75000	0.50000	0.25000
(1/2,0,0)' + set click here to show and hide
7	0.75000	0.00000	0.25000
8	0.25000	0.00000	0.75000

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

Atom	x	y	z
1	0.11590	0.04300	0.00000
(1/2,1/2,1/2) + set click here to show and hide
2	0.61590	0.54300	0.50000
(0,1/2,1/2)' + set click here to show and hide
3	0.11590	0.54300	0.50000
(1/2,0,0)' + set click here to show and hide
4	0.61590	0.04300	0.00000

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

Atom	x	y	z
1	0.88420	0.95700	0.00000
(1/2,1/2,1/2) + set click here to show and hide
2	0.38420	0.45700	0.50000
(0,1/2,1/2)' + set click here to show and hide
3	0.88420	0.45700	0.50000
(1/2,0,0)' + set click here to show and hide
4	0.38420	0.95700	0.00000

Set of atoms in the unit cell related by symmetry with the atom O2_3:

Atom	x	y	z
1	0.13420	0.29300	0.00000
(1/2,1/2,1/2) + set click here to show and hide
2	0.63420	0.79300	0.50000
(0,1/2,1/2)' + set click here to show and hide
3	0.13420	0.79300	0.50000
(1/2,0,0)' + set click here to show and hide
4	0.63420	0.29300	0.00000

Set of atoms in the unit cell related by symmetry with the atom O2_4:

Atom	x	y	z
1	0.36590	0.20700	0.00000
(1/2,1/2,1/2) + set click here to show and hide
2	0.86590	0.70700	0.50000
(0,1/2,1/2)' + set click here to show and hide
3	0.36590	0.70700	0.50000
(1/2,0,0)' + set click here to show and hide
4	0.86590	0.20700	0.00000

Set of atoms in the unit cell related by symmetry with the atom O2_5:

Atom	x	y	z
1	0.11590	0.04300	0.50000
(1/2,1/2,1/2) + set click here to show and hide
2	0.61590	0.54300	0.00000
(0,1/2,1/2)' + set click here to show and hide
3	0.11590	0.54300	0.00000
(1/2,0,0)' + set click here to show and hide
4	0.61590	0.04300	0.50000

Set of atoms in the unit cell related by symmetry with the atom O2_6:

Atom	x	y	z
1	0.88420	0.95700	0.50000
(1/2,1/2,1/2) + set click here to show and hide
2	0.38420	0.45700	0.00000
(0,1/2,1/2)' + set click here to show and hide
3	0.88420	0.45700	0.00000
(1/2,0,0)' + set click here to show and hide
4	0.38420	0.95700	0.50000

Set of atoms in the unit cell related by symmetry with the atom O2_7:

Atom	x	y	z
1	0.13420	0.29300	0.50000
(1/2,1/2,1/2) + set click here to show and hide
2	0.63420	0.79300	0.00000
(0,1/2,1/2)' + set click here to show and hide
3	0.13420	0.79300	0.00000
(1/2,0,0)' + set click here to show and hide
4	0.63420	0.29300	0.50000

Set of atoms in the unit cell related by symmetry with the atom O2_8:

Atom	x	y	z
1	0.36590	0.20700	0.50000
(1/2,1/2,1/2) + set click here to show and hide
2	0.86590	0.70700	0.00000
(0,1/2,1/2)' + set click here to show and hide
3	0.36590	0.70700	0.00000
(1/2,0,0)' + set click here to show and hide
4	0.86590	0.20700	0.50000

[Hide]

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Fe1_1	Fe	0.0000	0.0000	0.0000	4	m_x,m_y,0	-2.7(2)	-1.9(2)	0.0	3.30
Fe1_2	Fe	0.5000	0.5000	0.0000	4	m_x,m_y,0	-2.7(2)	-1.9(2)	0.0	3.30
Fe1_3	Fe	0.2500	0.2500	0.0000	4	m_x,m_y,0	2.7(2)	-1.9(2)	0.0	3.30
Fe1_4	Fe	0.7500	0.7500	0.0000	4	m_x,m_y,0	2.7(2)	-1.9(2)	0.0	3.30
Fe2_1	Fe	0.1300	0.0450	0.2500	8	m_x,m_y,m_z	1.54(9)	0.3(2)	3.10(4)	3.47
Fe2_2	Fe	0.3800	0.2050	0.7500	8	m_x,m_y,m_z	-1.54(9)	-0.3(2)	-3.10(4)	3.47
Fe2_3	Fe	0.1201	0.2950	0.7500	8	m_x,m_y,m_z	-1.54(9)	-0.3(2)	-3.10(4)	3.47
Fe2_4	Fe	0.8701	0.9550	0.2500	8	m_x,m_y,m_z	1.54(9)	0.3(2)	3.10(4)	3.47

[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: