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:   

BaFe2Se3 (#1.710)

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


Magnetic structure with all atoms

Magnetic structure with only magnetic atoms

Reference: W. G. Zheng, V. Baledent, E. Ressouche, V. Petricek, D. Bounoua, P. Bourges, Y. Sidis, A. Forget, D. Colson, P. Foury-Leylekian, PHYSICAL REVIEW B (2022) 106 134429
DOI: 10.1103/PhysRevB.106.134429
Atomic positions from: same reference

Parent space group (paramagnetic phase): Pm (#6)
Propagation vector: k1 (1/2, 1/2, 1/2)

Transition Temperature: 225(25) K
Experiment Temperature: 10 K

Lattice parameters of the magnetic unit cell:
23.7346 10.8978 18.2992 90.00 90.031 90.00
Transformation from parent structure: (2a,2b,2c;1/4,1/4,0)
    [View matrix form]

BNS Magnetic Space Group: Cam (#8.36) (non-standard)
    [View symmetry operations]
Transformation to a standard setting: (a,b,-1/2a+1/2c;0,0,0)
    [View matrix form]
Systematic absences for this Magnetic Space Group via

Magnetic Point Group: m.1' (4.2.10)
    [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|

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

Active Irreps:                                           
Irrep decomposition via

labeldim. full irrepdim. small irrepdirectionactionnumber of modes
mR1R2 4 4 special primary 12

Comments (symmetry):

Bilbao Crystallographic Server
For comments, please mail to