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

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La2NiO3F1.93 (#1.390)

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Magnetic structure with all atoms

Magnetic structure with only magnetic atoms


Reference: K. Wissel, A.M. Malik, S. Vasala, S. Plana-Ruiz, U. Kolb, P.R. Slater, I. da Silva, L. Alff, J. Rohrer and O. Clemens, Chemistry of Materials (2020) 32 3160-3179.
DOI: 10.1021/acs.chemmater.0c00193
Atomic positions from: same reference

Parent space group (paramagnetic phase): C2/c (#15)
Propagation vector: k1 (1, 0, 0)
Experiment Temperature: 10 K

Lattice parameters of the magnetic unit cell:
12.94130 5.76080 5.61860 90.00 88.51 90.00
Transformation from parent structure: (a,b,c;0,0,0)
    [View matrix form]

BNS Magnetic Space Group: PC21/c (#14.84) (non-standard)
    [View symmetry operations]
Transformation to a standard setting: (a,b,c;1/4,1/4,0)
    [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

     [Show only magnetic atoms]                                             Use MVISUALIZE to:
     [Show all the atoms]
                                        

LabelAtom typexyzMultiplicitySymmetry constraints on MMxMyMz|M|
Ni1Ni0.250000.250000.000004mx,my,mz0.00.01.62(7)1.62

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



Active Irreps:                                           
Irrep decomposition via


labeldim. small irrepdim. full irrepactionnumber of modes
mY2- 1 1 primary 3


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Comments (symmetry):

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