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

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Cr2S3 (#0.5)

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Magnetic structure with all atoms

Magnetic structure with only magnetic atoms


Reference: E. Bertaut, J. Cohen, B. Lambert-Andron and P. Mollard, Journal de Physique (1968) 29 813-824.
DOI: 10.1051/jphys:01968002908-9081300
Atomic positions from: ICSD #626604

Parent space group (paramagnetic phase): R-3 (#148)
Propagation vector: k1 (0, 0, 0)

Transition Temperature: 122 K
Experiment Temperature: 4.2 K

Lattice parameters of the magnetic unit cell:
5.9400 5.9400 16.7000 90.0000 90.0000 120.0000
Transformation from parent structure: (a,b,c;0,0,0)
    [View matrix form]

BNS Magnetic Space Group: P-1 (#2.4) (non-standard)
    [View symmetry operations]
Transformation to a standard setting: (a,-1/3a+1/3b+1/3c,c;0,0,0)
    [View matrix form]
Systematic absences for this Magnetic Space Group via

Magnetic Point Group: -1.1 (2.1.3)
    [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|
Cr1Cr0.000000.000000.000003mx,my,mz-1.050.00.581.20
Cr2Cr0.000000.000000.500003mx,my,mz-1.050.00.581.20
Cr3Cr0.000000.000000.330006mx,my,mz1.050.0-0.581.20

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



Active Irreps:                                           
Irrep decomposition via


labeldim. full irrepdim. small irrepdirectionactionpresence
mGM2+mGM3+ 2 2 general primary
mGM1+ 1 1 secondary yes


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Comments (symmetry):

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