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	0.00000	0.00000	0.00000	4	m_x,m_y,0	3.10(2)	-1.34(7)	0.0	3.38
Fe1_2	Fe	0.50000	0.50000	0.00000	4	m_x,m_y,0	3.1	-1.34	0.0	3.38
Fe1_3	Fe	0.25000	0.75000	0.00000	4	m_x,m_y,0	-3.1	-1.34	0.0	3.38
Fe1_4	Fe	0.75000	0.25000	0.00000	4	m_x,m_y,0	-3.1	-1.34	0.0	3.38
Fe2_1	Fe	0.12995	0.95500	0.75000	8	m_x,m_y,m_z	-0.69(2)	0.59(5)	3.18(1)	3.31
Fe2_2	Fe	0.37995	0.79500	0.25000	8	m_x,m_y,m_z	0.69	0.59	-3.18	3.31
Fe2_3	Fe	0.12005	0.70500	0.25000	8	m_x,m_y,m_z	0.69	0.59	-3.18	3.31
Fe2_4	Fe	0.87005	0.04500	0.75000	8	m_x,m_y,m_z	-0.69	0.59	3.18	3.31

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
Sr1_1	Sr	0.04465	0.82565	0.00000	4
Sr1_2	Sr	0.95535	0.17435	0.00000	4
Sr1_3	Sr	0.20535	0.57565	0.00000	4
Sr1_4	Sr	0.29465	0.92435	0.00000	4
Sr1_5	Sr	0.04465	0.82565	0.50000	4
Sr1_6	Sr	0.95535	0.17435	0.50000	4
Sr1_7	Sr	0.20535	0.57565	0.50000	4
Sr1_8	Sr	0.29465	0.92435	0.50000	4
Se1_1	Se	0.20015	0.83250	0.75000	8
Se1_2	Se	0.79985	0.16750	0.75000	8
Se1_3	Se	0.04985	0.58250	0.75000	8
Se1_4	Se	0.45015	0.91750	0.75000	8
O1_1	O	0.00000	0.75000	0.75000	8
O1_2	O	0.25000	0.00000	0.75000	8
O2_1	O	0.11585	0.95700	0.00000	4
O2_2	O	0.88415	0.04300	0.00000	4
O2_3	O	0.13415	0.70700	0.00000	4
O2_4	O	0.36585	0.79300	0.00000	4
O2_5	O	0.11585	0.95700	0.50000	4
O2_6	O	0.88415	0.04300	0.50000	4
O2_7	O	0.13415	0.70700	0.50000	4
O2_8	O	0.36585	0.79300	0.50000	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	3.10000	-1.34000	0.00000
(1/2,1/2,1/2) + set click here to show and hide
2	0.50000	0.50000	0.50000	m_x,m_y,0	3.10000	-1.34000	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	-3.10000	1.34000	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	-3.10000	1.34000	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	3.10000	-1.34000	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	3.10000	-1.34000	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	-3.10000	1.34000	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	-3.10000	1.34000	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	0.75000	0.00000	m_x,m_y,0	-3.10000	-1.34000	0.00000
(1/2,1/2,1/2) + set click here to show and hide
2	0.75000	0.25000	0.50000	m_x,m_y,0	-3.10000	-1.34000	0.00000
(0,1/2,1/2)' + set click here to show and hide
3	0.25000	0.25000	0.50000	-m_x,-m_y,0	3.10000	1.34000	0.00000
(1/2,0,0)' + set click here to show and hide
4	0.75000	0.75000	0.00000	-m_x,-m_y,0	3.10000	1.34000	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	0.25000	0.00000	m_x,m_y,0	-3.10000	-1.34000	0.00000
(1/2,1/2,1/2) + set click here to show and hide
2	0.25000	0.75000	0.50000	m_x,m_y,0	-3.10000	-1.34000	0.00000
(0,1/2,1/2)' + set click here to show and hide
3	0.75000	0.75000	0.50000	-m_x,-m_y,0	3.10000	1.34000	0.00000
(1/2,0,0)' + set click here to show and hide
4	0.25000	0.25000	0.00000	-m_x,-m_y,0	3.10000	1.34000	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	0.12995	0.95500	0.75000	m_x,m_y,m_z	-0.69000	0.59000	3.18000
2	0.62995	0.95500	0.25000	-m_x,-m_y,m_z	0.69000	-0.59000	3.18000
(1/2,1/2,1/2) + set click here to show and hide
3	0.62995	0.45500	0.25000	m_x,m_y,m_z	-0.69000	0.59000	3.18000
4	0.12995	0.45500	0.75000	-m_x,-m_y,m_z	0.69000	-0.59000	3.18000
(0,1/2,1/2)' + set click here to show and hide
5	0.12995	0.45500	0.25000	-m_x,-m_y,-m_z	0.69000	-0.59000	-3.18000
6	0.62995	0.45500	0.75000	m_x,m_y,-m_z	-0.69000	0.59000	-3.18000
(1/2,0,0)' + set click here to show and hide
7	0.62995	0.95500	0.75000	-m_x,-m_y,-m_z	0.69000	-0.59000	-3.18000
8	0.12995	0.95500	0.25000	m_x,m_y,-m_z	-0.69000	0.59000	-3.18000

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	0.37995	0.79500	0.25000	m_x,m_y,m_z	0.69000	0.59000	-3.18000
2	0.87995	0.79500	0.75000	-m_x,-m_y,m_z	-0.69000	-0.59000	-3.18000
(1/2,1/2,1/2) + set click here to show and hide
3	0.87995	0.29500	0.75000	m_x,m_y,m_z	0.69000	0.59000	-3.18000
4	0.37995	0.29500	0.25000	-m_x,-m_y,m_z	-0.69000	-0.59000	-3.18000
(0,1/2,1/2)' + set click here to show and hide
5	0.37995	0.29500	0.75000	-m_x,-m_y,-m_z	-0.69000	-0.59000	3.18000
6	0.87995	0.29500	0.25000	m_x,m_y,-m_z	0.69000	0.59000	3.18000
(1/2,0,0)' + set click here to show and hide
7	0.87995	0.79500	0.25000	-m_x,-m_y,-m_z	-0.69000	-0.59000	3.18000
8	0.37995	0.79500	0.75000	m_x,m_y,-m_z	0.69000	0.59000	3.18000

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	0.12005	0.70500	0.25000	m_x,m_y,m_z	0.69000	0.59000	-3.18000
2	0.62005	0.70500	0.75000	-m_x,-m_y,m_z	-0.69000	-0.59000	-3.18000
(1/2,1/2,1/2) + set click here to show and hide
3	0.62005	0.20500	0.75000	m_x,m_y,m_z	0.69000	0.59000	-3.18000
4	0.12005	0.20500	0.25000	-m_x,-m_y,m_z	-0.69000	-0.59000	-3.18000
(0,1/2,1/2)' + set click here to show and hide
5	0.12005	0.20500	0.75000	-m_x,-m_y,-m_z	-0.69000	-0.59000	3.18000
6	0.62005	0.20500	0.25000	m_x,m_y,-m_z	0.69000	0.59000	3.18000
(1/2,0,0)' + set click here to show and hide
7	0.62005	0.70500	0.25000	-m_x,-m_y,-m_z	-0.69000	-0.59000	3.18000
8	0.12005	0.70500	0.75000	m_x,m_y,-m_z	0.69000	0.59000	3.18000

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	0.87005	0.04500	0.75000	m_x,m_y,m_z	-0.69000	0.59000	3.18000
2	0.37005	0.04500	0.25000	-m_x,-m_y,m_z	0.69000	-0.59000	3.18000
(1/2,1/2,1/2) + set click here to show and hide
3	0.37005	0.54500	0.25000	m_x,m_y,m_z	-0.69000	0.59000	3.18000
4	0.87005	0.54500	0.75000	-m_x,-m_y,m_z	0.69000	-0.59000	3.18000
(0,1/2,1/2)' + set click here to show and hide
5	0.87005	0.54500	0.25000	-m_x,-m_y,-m_z	0.69000	-0.59000	-3.18000
6	0.37005	0.54500	0.75000	m_x,m_y,-m_z	-0.69000	0.59000	-3.18000
(1/2,0,0)' + set click here to show and hide
7	0.37005	0.04500	0.75000	-m_x,-m_y,-m_z	0.69000	-0.59000	-3.18000
8	0.87005	0.04500	0.25000	m_x,m_y,-m_z	-0.69000	0.59000	-3.18000

Non-magnetic atoms:

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

Atom	x	y	z
1	0.04465	0.82565	0.00000
(1/2,1/2,1/2) + set click here to show and hide
2	0.54465	0.32565	0.50000
(0,1/2,1/2)' + set click here to show and hide
3	0.04465	0.32565	0.50000
(1/2,0,0)' + set click here to show and hide
4	0.54465	0.82565	0.00000

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

Atom	x	y	z
1	0.95535	0.17435	0.00000
(1/2,1/2,1/2) + set click here to show and hide
2	0.45535	0.67435	0.50000
(0,1/2,1/2)' + set click here to show and hide
3	0.95535	0.67435	0.50000
(1/2,0,0)' + set click here to show and hide
4	0.45535	0.17435	0.00000

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

Atom	x	y	z
1	0.20535	0.57565	0.00000
(1/2,1/2,1/2) + set click here to show and hide
2	0.70535	0.07565	0.50000
(0,1/2,1/2)' + set click here to show and hide
3	0.20535	0.07565	0.50000
(1/2,0,0)' + set click here to show and hide
4	0.70535	0.57565	0.00000

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

Atom	x	y	z
1	0.29465	0.92435	0.00000
(1/2,1/2,1/2) + set click here to show and hide
2	0.79465	0.42435	0.50000
(0,1/2,1/2)' + set click here to show and hide
3	0.29465	0.42435	0.50000
(1/2,0,0)' + set click here to show and hide
4	0.79465	0.92435	0.00000

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

Atom	x	y	z
1	0.04465	0.82565	0.50000
(1/2,1/2,1/2) + set click here to show and hide
2	0.54465	0.32565	0.00000
(0,1/2,1/2)' + set click here to show and hide
3	0.04465	0.32565	0.00000
(1/2,0,0)' + set click here to show and hide
4	0.54465	0.82565	0.50000

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

Atom	x	y	z
1	0.95535	0.17435	0.50000
(1/2,1/2,1/2) + set click here to show and hide
2	0.45535	0.67435	0.00000
(0,1/2,1/2)' + set click here to show and hide
3	0.95535	0.67435	0.00000
(1/2,0,0)' + set click here to show and hide
4	0.45535	0.17435	0.50000

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

Atom	x	y	z
1	0.20535	0.57565	0.50000
(1/2,1/2,1/2) + set click here to show and hide
2	0.70535	0.07565	0.00000
(0,1/2,1/2)' + set click here to show and hide
3	0.20535	0.07565	0.00000
(1/2,0,0)' + set click here to show and hide
4	0.70535	0.57565	0.50000

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

Atom	x	y	z
1	0.29465	0.92435	0.50000
(1/2,1/2,1/2) + set click here to show and hide
2	0.79465	0.42435	0.00000
(0,1/2,1/2)' + set click here to show and hide
3	0.29465	0.42435	0.00000
(1/2,0,0)' + set click here to show and hide
4	0.79465	0.92435	0.50000

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

Atom	x	y	z
1	0.20015	0.83250	0.75000
2	0.70015	0.83250	0.25000
(1/2,1/2,1/2) + set click here to show and hide
3	0.70015	0.33250	0.25000
4	0.20015	0.33250	0.75000
(0,1/2,1/2)' + set click here to show and hide
5	0.20015	0.33250	0.25000
6	0.70015	0.33250	0.75000
(1/2,0,0)' + set click here to show and hide
7	0.70015	0.83250	0.75000
8	0.20015	0.83250	0.25000

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

Atom	x	y	z
1	0.79985	0.16750	0.75000
2	0.29985	0.16750	0.25000
(1/2,1/2,1/2) + set click here to show and hide
3	0.29985	0.66750	0.25000
4	0.79985	0.66750	0.75000
(0,1/2,1/2)' + set click here to show and hide
5	0.79985	0.66750	0.25000
6	0.29985	0.66750	0.75000
(1/2,0,0)' + set click here to show and hide
7	0.29985	0.16750	0.75000
8	0.79985	0.16750	0.25000

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

Atom	x	y	z
1	0.04985	0.58250	0.75000
2	0.54985	0.58250	0.25000
(1/2,1/2,1/2) + set click here to show and hide
3	0.54985	0.08250	0.25000
4	0.04985	0.08250	0.75000
(0,1/2,1/2)' + set click here to show and hide
5	0.04985	0.08250	0.25000
6	0.54985	0.08250	0.75000
(1/2,0,0)' + set click here to show and hide
7	0.54985	0.58250	0.75000
8	0.04985	0.58250	0.25000

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

Atom	x	y	z
1	0.45015	0.91750	0.75000
2	0.95015	0.91750	0.25000
(1/2,1/2,1/2) + set click here to show and hide
3	0.95015	0.41750	0.25000
4	0.45015	0.41750	0.75000
(0,1/2,1/2)' + set click here to show and hide
5	0.45015	0.41750	0.25000
6	0.95015	0.41750	0.75000
(1/2,0,0)' + set click here to show and hide
7	0.95015	0.91750	0.75000
8	0.45015	0.91750	0.25000

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

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

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

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

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

Atom	x	y	z
1	0.11585	0.95700	0.00000
(1/2,1/2,1/2) + set click here to show and hide
2	0.61585	0.45700	0.50000
(0,1/2,1/2)' + set click here to show and hide
3	0.11585	0.45700	0.50000
(1/2,0,0)' + set click here to show and hide
4	0.61585	0.95700	0.00000

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

Atom	x	y	z
1	0.88415	0.04300	0.00000
(1/2,1/2,1/2) + set click here to show and hide
2	0.38415	0.54300	0.50000
(0,1/2,1/2)' + set click here to show and hide
3	0.88415	0.54300	0.50000
(1/2,0,0)' + set click here to show and hide
4	0.38415	0.04300	0.00000

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

Atom	x	y	z
1	0.13415	0.70700	0.00000
(1/2,1/2,1/2) + set click here to show and hide
2	0.63415	0.20700	0.50000
(0,1/2,1/2)' + set click here to show and hide
3	0.13415	0.20700	0.50000
(1/2,0,0)' + set click here to show and hide
4	0.63415	0.70700	0.00000

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

Atom	x	y	z
1	0.36585	0.79300	0.00000
(1/2,1/2,1/2) + set click here to show and hide
2	0.86585	0.29300	0.50000
(0,1/2,1/2)' + set click here to show and hide
3	0.36585	0.29300	0.50000
(1/2,0,0)' + set click here to show and hide
4	0.86585	0.79300	0.00000

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

Atom	x	y	z
1	0.11585	0.95700	0.50000
(1/2,1/2,1/2) + set click here to show and hide
2	0.61585	0.45700	0.00000
(0,1/2,1/2)' + set click here to show and hide
3	0.11585	0.45700	0.00000
(1/2,0,0)' + set click here to show and hide
4	0.61585	0.95700	0.50000

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

Atom	x	y	z
1	0.88415	0.04300	0.50000
(1/2,1/2,1/2) + set click here to show and hide
2	0.38415	0.54300	0.00000
(0,1/2,1/2)' + set click here to show and hide
3	0.88415	0.54300	0.00000
(1/2,0,0)' + set click here to show and hide
4	0.38415	0.04300	0.50000

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

Atom	x	y	z
1	0.13415	0.70700	0.50000
(1/2,1/2,1/2) + set click here to show and hide
2	0.63415	0.20700	0.00000
(0,1/2,1/2)' + set click here to show and hide
3	0.13415	0.20700	0.00000
(1/2,0,0)' + set click here to show and hide
4	0.63415	0.70700	0.50000

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

Atom	x	y	z
1	0.36585	0.79300	0.50000
(1/2,1/2,1/2) + set click here to show and hide
2	0.86585	0.29300	0.00000
(0,1/2,1/2)' + set click here to show and hide
3	0.36585	0.29300	0.00000
(1/2,0,0)' + set click here to show and hide
4	0.86585	0.79300	0.50000

[Hide]

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Fe1_1	Fe	0.00000	0.00000	0.00000	4	m_x,m_y,0	3.10(2)	-1.34(7)	0.0	3.38
Fe1_2	Fe	0.50000	0.50000	0.00000	4	m_x,m_y,0	3.1	-1.34	0.0	3.38
Fe1_3	Fe	0.25000	0.75000	0.00000	4	m_x,m_y,0	-3.1	-1.34	0.0	3.38
Fe1_4	Fe	0.75000	0.25000	0.00000	4	m_x,m_y,0	-3.1	-1.34	0.0	3.38
Fe2_1	Fe	0.12995	0.95500	0.75000	8	m_x,m_y,m_z	-0.69(2)	0.59(5)	3.18(1)	3.31
Fe2_2	Fe	0.37995	0.79500	0.25000	8	m_x,m_y,m_z	0.69	0.59	-3.18	3.31
Fe2_3	Fe	0.12005	0.70500	0.25000	8	m_x,m_y,m_z	0.69	0.59	-3.18	3.31
Fe2_4	Fe	0.87005	0.04500	0.75000	8	m_x,m_y,m_z	-0.69	0.59	3.18	3.31

[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: