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

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Mn5(PO4)2(PO3(OH))2(HOH)4 (#0.764)

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Magnetic structure with all atoms

Magnetic structure with only magnetic atoms


Reference: S. Park, A. Hartl, D. Sheptyakov, M. Hoelzel, A. Arauzo, Symmetry (2021) 13 1688
DOI: 10.3390/sym13091688
Atomic positions from: same reference

Parent space group (paramagnetic phase): C2/c (#15)
Propagation vector: k1 (0, 0, 0)

Transition Temperature: 6.17 K
Experiment Temperature: 4.5 K

Lattice parameters of the magnetic unit cell:
17.5740(3) 9.1188(2) 9.4946(2) 90.00 96.393(1) 90.00
Transformation from parent structure: (a,b,c;0,0,0)
    [View matrix form]

BNS Magnetic Space Group: C2'/c' (#15.89) (standard setting)
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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: 2'/m' (5.5.16)
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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:
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LabelAtom typexyzMultiplicitySymmetry constraints on MMxMyMz|M|
Mn1Mn0.000000.397300.250004mx,0,mz0.6(2)0.0-3.0(1)3.12
Mn2Mn0.318100.411100.185708mx,my,mz1.5(1)0.1(2)-3.8(1)4.24
Mn3Mn0.325000.025500.133408mx,my,mz2.9(1)0.1(2)2.48(8)3.60

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



Active Irreps:                                           
Irrep decomposition via


labeldim. small irrepdim. full irrepactionnumber of modes
mGM2+ 1 1 primary 8


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Comments (symmetry):

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