MAGNDATA arrow Collection of Magnetic Structures


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

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FeOOH (#0.399)

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Magnetic structure with all atoms

Magnetic structure with only magnetic atoms


Reference: E. Zepeda-Alarcon, H. Nakotte, A. F. Gualtieri, G. King, K. Page, S. C. Vogel, H.-W. Wang, H.-R. Wenk et al., J. Appl. Cryst. (2014) 47 1983 - 1991
DOI: 10.1107/S1600576714022651
Atomic positions from: ICSD #239321

Parent space group (paramagnetic phase): Pbnm (#62) (non-standard)
Transformation to a standard setting: (b,c,a;0,0,0)
    [View matrix form]
Propagation vector: k1 (0, 0, 0)

Transition Temperature: 340-440 K
Experiment Temperature: 15K K

Lattice parameters of the magnetic unit cell:
4.59750 9.94120 3.01330 90.00 90.00 90.00
Transformation from parent structure: (a,b,c;0,0,0)
    [View matrix form]

BNS Magnetic Space Group: Pnma' (#62.445) (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: m'mm (8.3.26)
    [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|
Fe1Fe0.548330.646220.7500040,0,mz0.00.04.45(3)4.45

    [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 1


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Comments (symmetry):

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