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

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Sc2NiMnO6 (#1.199)

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Magnetic structure with all atoms

Magnetic structure with only magnetic atoms


Reference: W. Yi, A.J. Princep, Y. Guo, R.D. Johnson, D. Khalyavin, P. Manuel, A. Senyshyn, I.A. Presniakov, A.V. Sobolev, Y. Matsushita, M. Tanaka, A.A. Belik and A.T. Boothroyd, Inorganic Chemistry (2015) 54 8012-8021.
DOI: 10.1021/acs.inorgchem.5b01195
Atomic positions from: ICSD #251833

Parent space group (paramagnetic phase): P21/c (#14) (non-standard)
Transformation to a standard setting: (a,b,a+c;0,0,0)
    [View matrix form]
Propagation vector: k1 (1/2, 0, 1/2)

Transition Temperature: 35 K

Lattice parameters of the magnetic unit cell:
9.98170 5.35270 14.68240 90.00 90.87 90.00
Transformation from parent structure: (2a,b,2c;0,0,0)
    [View matrix form]

BNS Magnetic Space Group: Pa21/c (#14.80) (non-standard)
    [View symmetry operations]
Transformation to a standard setting: (a,b,1/2a+1/2c;0,0,0)
    [View matrix form]
Systematic absences for this Magnetic Space Group via

Magnetic Point Group: 2/m.1' (5.2.13)
    [View symmetry operations]
Symmetry-adapted form of material tensors via
Symmetry-adapted form of material tensors for domain-related equivalent structures via

Positions and magnetic moments of symmetry independent atoms:
From now on, magnetic atoms are in boldface and colored in red. Magnetic moments are expressed in units of μB

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LabelAtom typexyzMultiplicitySymmetry constraints on MMxMyMz|M|
Mn1Mn0.250000.000000.250008mx,my,mz1.170.01.191.66
Ni1Ni0.250000.000000.0000080,0,00.00.00.00.00

    [Show all magnetic atoms in unit cell and their moment relations]



Active Irreps:                                           
Irrep decomposition via


labeldim. small irrepdim. full irrepactionnumber of modes
mY1+ 1 1 primary 3


Comments:
Comments (symmetry):

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