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

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UCr2Si2C (#0.499)

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Magnetic structure with all atoms

Magnetic structure with only magnetic atoms


Reference: P. Lemoine, A. Verniere, M. Pasturel, G. Venturini and B. Malaman, Inorganic Chemistry (2018) 57 2546-2557.
DOI: 10.1021/acs.inorgchem.7b02901
Atomic positions from: ICSD #432804

Parent space group (paramagnetic phase): P4/mmm (#123)
Propagation vector: k1 (0, 0, 0)
Experiment Temperature: 2 K

Lattice parameters of the magnetic unit cell:
3.98300 3.98300 5.16000 90.00 90.00 90.00
Transformation from parent structure: (a,b,c;0,0,0)
    [View matrix form]

BNS Magnetic Space Group: Pm'm'm (#47.252) (non-standard)
    [View symmetry operations]
Transformation to a standard setting: (-c,b,a;0,0,0)
    [View matrix form]
Systematic absences for this Magnetic Space Group via

Magnetic Point Group: m'm'm (8.4.27)
    [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|
U1U0.000000.000000.000001mx,0,00.00.00.00.00
Cr1_1Cr0.000000.500000.500001mx,0,00.66(5)0.00.00.66
Cr1_2Cr0.500000.000000.500001mx,0,0-0.660.00.00.66

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



Active Irreps:                                           
Irrep decomposition via


labeldim. full irrepdim. small irrepdirectionactionnumber of modes
mGM5+ 2 2 special primary 3


Comments:
Comments (symmetry):

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