MAGNDATA arrow Collection of Magnetic Structures


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

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MnNb3S6 (#0.710)

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Magnetic structure with all atoms

Magnetic structure with only magnetic atoms


Reference: B. Van Laar, H.M. Rietveld, D.J.W. Ijdo, JOURNAL OF SOLID STATE CHEMISTRY (1971) 3 154 - 160
DOI: 10.1016/0022-4596(71)90019-3
Atomic positions from: ICSD #76073

Parent space group (paramagnetic phase): P6322 (#182)
Propagation vector: k1 (0, 0, 0)
Experiment Temperature: 4.2 K

Lattice parameters of the magnetic unit cell:
5.77940 5.77940 12.59930 90.00 90.00 120.00
Transformation from parent structure: (a,b,c;0,0,0)
    [View matrix form]

BNS Magnetic Space Group: C22'21' (#20.34) (non-standard)
    [View symmetry operations]
Transformation to a standard setting: (-b,2a+b,c;0,0,0)
    [View matrix form]
Systematic absences for this Magnetic Space Group via

Magnetic Point Group: 2'2'2 (6.3.19)
    [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 typexyzOccupancyMultiplicitySymmetry constraints on MMxMyMz|M|
Mn1Mn0.333330.666670.250000.9420,my,mz0.04.0(1)0.04.00
Mn2Mn0.333330.666670.750000.0520,my,mz0.00.00.00.00
Mn3Mn0.000000.000000.250000.0120,my,mz0.00.00.00.00

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



Active Irreps:                                           
Irrep decomposition via


labeldim. full irrepdim. small irrepdirectionactionnumber of modes
mGM6 2 2 special primary 6


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Comments (symmetry):

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