MAGNDATA - Collection of Magnetic Structures

N	(x,y,z)	Seitz notation
1	x,y,z,+1	{ 1 \| 0 }
2	-x+1/2,y+1/2,-z+3/4,+1	{ 2₀₁₀ \| 1/2 1/2 3/4 }
(0,0,1/2)' + set click here to show and hide
3	x,y,z+1/2,-1	{ 1' \| 0 0 1/2 }
4	-x+1/2,y+1/2,-z+1/4,-1	{ 2'₀₁₀ \| 1/2 1/2 1/4 }

N	(x,y,z)	Seitz notation
1	x,y,z,+1	1
2	-x,y,-z,+1	2₀₁₀
1' + set click here to show and hide
3	x,y,z,-1	1'
4	-x,y,-z,-1	2'₀₁₀

Magnetic atoms:

Label	Atom type	x	y	z	Occupancy	Multiplicity	Symmetry constraints on M	M_x	M_z	\|M\|
Yb1_1	Yb	0.02130	0.07410	0.37450	0.5	4	m_x,m_y,m_z	0.0	0.0	0.00
Yb1_2	Yb	0.97870	0.92590	0.62550	0.5	4	m_x,m_y,m_z	0.0	0.89(12)	0.89
Co1	Co	0.50000	0.00000	0.25000	1.	4	m_x,m_y,m_z	0.41(6)	1.24(3)	1.30
Mn1	Mn	0.50000	0.00000	0.00000	1.	4	m_x,m_y,m_z	0.41	1.24	1.30

Non-magnetic atoms:

Label	Atom type	x	y	z	Occupancy	Multiplicity
Lu1_1	Lu	0.02130	0.07410	0.37450	0.5	4
Lu1_2	Lu	0.97870	0.92590	0.62550	0.5	4
O1_1	O	0.29850	0.32090	0.47455	1.	4
O1_2	O	0.70150	0.67910	0.52545	1.	4
O2_1	O	0.32800	0.29600	0.28070	1.	4
O2_2	O	0.67200	0.70400	0.71930	1.	4
O3_1	O	0.88510	0.45780	0.38095	1.	4
O3_2	O	0.11490	0.54220	0.61905	1.	4

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 Yb1_1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.02130	0.07410	0.37450	m_x,m_y,m_z	0.00000	0.00000	0.00000
2	0.47870	0.57410	0.37550	-m_x,m_y,-m_z	0.00000	0.00000	0.00000
(0,0,1/2)' + set click here to show and hide
3	0.02130	0.07410	0.87450	-m_x,-m_y,-m_z	0.00000	0.00000	0.00000
4	0.47870	0.57410	0.87550	m_x,-m_y,m_z	0.00000	0.00000	0.00000

Set of atoms in the unit cell related by symmetry with the magnetic atom Yb1_2:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.97870	0.92590	0.62550	m_x,m_y,m_z	0.00000	0.00000	0.89000
2	0.52130	0.42590	0.12450	-m_x,m_y,-m_z	0.00000	0.00000	-0.89000
(0,0,1/2)' + set click here to show and hide
3	0.97870	0.92590	0.12550	-m_x,-m_y,-m_z	0.00000	0.00000	-0.89000
4	0.52130	0.42590	0.62450	m_x,-m_y,m_z	0.00000	0.00000	0.89000

Set of atoms in the unit cell related by symmetry with the magnetic atom Co1:

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.50000	0.00000	0.25000	m_x,m_y,m_z	0.41000	0.00000	1.24000
2	0.00000	0.50000	0.50000	-m_x,m_y,-m_z	-0.41000	0.00000	-1.24000
(0,0,1/2)' + set click here to show and hide
3	0.50000	0.00000	0.75000	-m_x,-m_y,-m_z	-0.41000	0.00000	-1.24000
4	0.00000	0.50000	0.00000	m_x,-m_y,m_z	0.41000	0.00000	1.24000

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	0.50000	0.00000	0.00000	m_x,m_y,m_z	0.41000	0.00000	1.24000
2	0.00000	0.50000	0.75000	-m_x,m_y,-m_z	-0.41000	0.00000	-1.24000
(0,0,1/2)' + set click here to show and hide
3	0.50000	0.00000	0.50000	-m_x,-m_y,-m_z	-0.41000	0.00000	-1.24000
4	0.00000	0.50000	0.25000	m_x,-m_y,m_z	0.41000	0.00000	1.24000

Non-magnetic atoms:

Set of atoms in the unit cell related by symmetry with the atom Lu1_1:

Atom	x	y	z
1	0.02130	0.07410	0.37450
2	0.47870	0.57410	0.37550
(0,0,1/2)' + set click here to show and hide
3	0.02130	0.07410	0.87450
4	0.47870	0.57410	0.87550

Set of atoms in the unit cell related by symmetry with the atom Lu1_2:

Atom	x	y	z
1	0.97870	0.92590	0.62550
2	0.52130	0.42590	0.12450
(0,0,1/2)' + set click here to show and hide
3	0.97870	0.92590	0.12550
4	0.52130	0.42590	0.62450

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

Atom	x	y	z
1	0.29850	0.32090	0.47455
2	0.20150	0.82090	0.27545
(0,0,1/2)' + set click here to show and hide
3	0.29850	0.32090	0.97455
4	0.20150	0.82090	0.77545

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

Atom	x	y	z
1	0.70150	0.67910	0.52545
2	0.79850	0.17910	0.22455
(0,0,1/2)' + set click here to show and hide
3	0.70150	0.67910	0.02545
4	0.79850	0.17910	0.72455

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

Atom	x	y	z
1	0.32800	0.29600	0.28070
2	0.17200	0.79600	0.46930
(0,0,1/2)' + set click here to show and hide
3	0.32800	0.29600	0.78070
4	0.17200	0.79600	0.96930

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

Atom	x	y	z
1	0.67200	0.70400	0.71930
2	0.82800	0.20400	0.03070
(0,0,1/2)' + set click here to show and hide
3	0.67200	0.70400	0.21930
4	0.82800	0.20400	0.53070

Set of atoms in the unit cell related by symmetry with the atom O3_1:

Atom	x	y	z
1	0.88510	0.45780	0.38095
2	0.61490	0.95780	0.36905
(0,0,1/2)' + set click here to show and hide
3	0.88510	0.45780	0.88095
4	0.61490	0.95780	0.86905

Set of atoms in the unit cell related by symmetry with the atom O3_2:

Atom	x	y	z
1	0.11490	0.54220	0.61905
2	0.38510	0.04220	0.13095
(0,0,1/2)' + set click here to show and hide
3	0.11490	0.54220	0.11905
4	0.38510	0.04220	0.63095

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Label	Atom type	x	y	z	Occupancy	Multiplicity	Symmetry constraints on M	M_x	M_z	\|M\|
Yb1_1	Yb	0.02130	0.07410	0.37450	0.5	4	m_x,m_y,m_z	0.0	0.0	0.00
Yb1_2	Yb	0.97870	0.92590	0.62550	0.5	4	m_x,m_y,m_z	0.0	0.89(12)	0.89
Co1	Co	0.50000	0.00000	0.25000	1.	4	m_x,m_y,m_z	0.41(6)	1.24(3)	1.30
Mn1	Mn	0.50000	0.00000	0.00000	1.	4	m_x,m_y,m_z	0.41	1.24	1.30

label	dim. full irrep	dim. small irrep	direction	action	number of modes
mB1	2	2	special	primary	12

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