MAGNDATA arrow Collection of Magnetic Structures


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

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Mn3O4 (#1.1)

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Magnetic structure with all atoms

Magnetic structure with only magnetic atoms


Reference: S. Hirai, A.M. dos Santos, M.C. Shapiro, J.J. Molaison, N. Pradhan, M. Guthrie, C.A. Tulk, I.R. Fisher and W.L. Mao, Physical Review B (2013) 87.
DOI: 10.1103/physrevb.87.014417
Atomic positions from: same reference

Parent space group (paramagnetic phase): Pbcm (#57)
Propagation vector: k1 (1/2, 0, 0)

Transition Temperature: 210 K
Experiment Temperature: 60 K

Lattice parameters of the magnetic unit cell:
6.0640 9.8420 9.5680 90.00 90.00 90.00
Transformation from parent structure: (2a,b,c;0,0,0)
    [View matrix form]

BNS Magnetic Space Group: Pcnma (#62.452) (non-standard)
    [View symmetry operations]
Transformation to a standard setting: (b,c,a;0,0,0)
    [View matrix form]
Systematic absences for this Magnetic Space Group via

Magnetic Point Group: mmm1' (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 typexyzMultiplicitySymmetry constraints on MMxMyMz|M|
Mn1Mn0.1540.1140.0716mx,my,mz3.49(2)0.00.03.49
Mn2Mn0.380.1370.7580,0,mz0.00.00.00.00

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



Active Irreps:                                           
Irrep decomposition via


labeldim. small irrepdim. full irrepaction
mX2+ 1 1 primary


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Comments (symmetry):

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