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

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VOCl (#1.37)

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Magnetic structure with all atoms

Magnetic structure with only magnetic atoms


Reference: A.C. Komarek, T. Taetz, M.T. Fernandez-Diaz, D.M. Trots, A. Moller and M. Braden, Physical Review B (2009) 79.
DOI: 10.1103/physrevb.79.104425
Atomic positions from: same reference

Parent space group (paramagnetic phase): Pmmn (#59)
Propagation vector: k1 (1/2, 1/2, 1/2)

Transition Temperature: 80 K
Experiment Temperature: 2 K

Lattice parameters of the magnetic unit cell:
7.53500 6.58090 15.79160 90.00 90.00 90.21
Transformation from parent structure: (2a,2b,2c;0,0,0)
    [View matrix form]

BNS Magnetic Space Group: Ca2/c (#15.91) (non-standard)
    [View symmetry operations]
Transformation to a standard setting: (a,c,-1/2a-1/2b;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

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

LabelAtom typexyzMultiplicitySymmetry constraints on MMxMyMz|M|
VV0.375000.125000.0583916mx,my,01.30.00.01.30

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



Active Irreps:                                           
Irrep decomposition via


labeldim. full irrepdim. small irrepdirectionaction
mR1 2 2 special primary


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