MAGNDATA arrow Collection of Magnetic Structures


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

Log in


  Element search (separate with space or comma):     View Full Database  Advanced Search

To upload any published structure click HERE


  Enter the label of the structure:   

Bi4Fe5O13F (#1.11)

view in Jmol
Download mcif file
Download vesta file (all atoms)
Download vesta file (magnetic atoms only)


working...


Magnetic structure with all atoms

Magnetic structure with only magnetic atoms


Reference: A.M. Abakumov, D. Batuk, A.A. Tsirlin, C. Prescher, L. Dubrovinsky, D.V. Sheptyakov, W. Schnelle, J. Hadermann and G.V. Tendeloo, Physical Review B (2013) 87.
DOI: 10.1103/physrevb.87.024423
Atomic positions from: same reference

Parent space group (paramagnetic phase): P42/mbc (#135)
Propagation vector: k1 (1/2, 1/2, 0)

Transition Temperature: 178 K
Experiment Temperature: 1.5 K

Lattice parameters of the magnetic unit cell:
11.7192 11.7192 18.0501 90.0000 90.0000 90.0000
Transformation from parent structure: (a-b,a+b,c;0,0, 0)
    [View matrix form]

BNS Magnetic Space Group: PC42/n (#86.73) (non-standard)
    [View symmetry operations]
Transformation to a standard setting: (a,b,c;1/4,1/4,0)
    [View matrix form]
Systematic absences for this Magnetic Space Group via

Magnetic Point Group: 4/m.1' (11.2.36)
    [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|
Fe1_1Fe0.250000.250000.080108mx,my,04.05-0.350.04.07
Fe1_2Fe0.250000.250000.419908mx,my,04.05-0.350.04.07
Fe2_1Fe0.006300.844800.000008mx,my,02.18-2.530.03.34
Fe2_2Fe0.00630-0.344800.500008mx,my,02.53-2.180.03.34
Fe3Fe0.250000.250000.250008mx,my,04.050.350.04.07

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



Active Irreps:                                           
Irrep decomposition via


labeldim. full irrepdim. small irrepdirectionaction
mM5- 2 2 special primary


Comments:
Comments (symmetry):

Bilbao Crystallographic Server
https://www.cryst.ehu.es
For comments, please mail to
administrador.bcs@ehu.eus