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

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Nd2NiO4.11 (#0.247)

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Magnetic structure with all atoms

Magnetic structure with only magnetic atoms


Reference: S.R. Maity, M. Ceretti, L. Keller, J. Schefer, T. Shang, E. Pomjakushina, M. Meven, D. Sheptyakov, A. Cervellino and W. Paulus, Physical Review Materials (2019) 3 083604.
DOI: 10.1103/physrevmaterials.3.083604
Atomic positions from: same reference

Parent space group (paramagnetic phase): P42/ncm (#138)
Propagation vector: k1 (0, 0, 0)

Transition Temperature: 53 K
Experiment Temperature: 2 K

Lattice parameters of the magnetic unit cell:
5.45870 5.45870 12.15380 90.00 90.00 90.00
Transformation from parent structure: (a,b,c;0,0,0)
    [View matrix form]

BNS Magnetic Space Group: P42/nc'm' (#138.525) (standard setting)
    [View symmetry operations]
Transformation to a standard setting: (a,b,c;0,0,0)
    [View matrix form]
Systematic absences for this Magnetic Space Group via

Magnetic Point Group: 4/mm'm' (15.6.58)
    [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|
Nd1Nd0.987310.987310.361048mx,mx,mz1.15(3)1.150.01.63
Ni1Ni0.000000.000000.000004mx,mx,mz0.81(5)0.810.01.15

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



Active Irreps:                                           
Irrep decomposition via


labeldim. small irrepdim. full irrepactionnumber of modes
mGM3+ 1 1 primary 2


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Comments (symmetry):

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