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

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NdCeBaCuFeO7 (#1.395)

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Magnetic structure with all atoms

Magnetic structure with only magnetic atoms


Reference: R.K. Li, L. Gu and C. Greaves, Physical Review B (2002) 65 104439.
DOI: 10.1103/physrevb.65.104439
Atomic positions from: same reference

Parent space group (paramagnetic phase): I4/mmm (#139)
Propagation vector: k1 (1/2, -1/2, 0)
Experiment Temperature: 5 K

Lattice parameters of the magnetic unit cell:
5.50780 5.50780 20.82450 90.00 90.00 90.00
Transformation from parent structure: (a-b,a+b,c;0,0,1/2)
    [View matrix form]

BNS Magnetic Space Group: CAccm (#66.500) (non-standard)
    [View symmetry operations]
Transformation to a standard setting: (c,b,-a;0,1/4,-1/4)
    [View matrix form]
Systematic absences for this Magnetic Space Group via

Magnetic Point Group: mmm.1' (8.2.25)
    [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|
Fe1Fe0.500000.500000.096830.58mx,0,01.46(3)0.00.01.46

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



Active Irreps:                                           
Irrep decomposition via


labeldim. small irrepdim. full irrepactionnumber of modes
mX4+ 1 2 primary 1


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Comments (symmetry):

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