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:   

Pb2Mn0.6Co0.4WO6 (#2.17)

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: F. Orlandi, L. Righi, F. Mezzadri, P. Manuel, D.D. Khalyavin, D. Delmonte, C. Pernechele, R. Cabassi, F. Bolzoni, M. Solzi and G. Calestani, Inorganic Chemistry (2016) 55 4381-4390.
DOI: 10.1021/acs.inorgchem.6b00117
Atomic positions from: same reference

Parent space group (paramagnetic phase): Pmcn (#62) (non-standard)
Transformation to a standard setting: (c,a,b;0,0,0)
    [View matrix form]
Propagation vector(s):
k1 (1/2, 0, 0)
k2 (0, 0, 0)

Transition Temperature: 9 K
Experiment Temperature: 1.5 K

Lattice parameters of the magnetic unit cell:
15.983600 5.742180 11.527200 90.000000 90.000000 90.000000
Transformation from parent structure: (2a,b,c;0,0,0)
    [View matrix form]

BNS Magnetic Space Group: Pm'c21' (#26.68) (standard setting)
    [View symmetry operations]
Systematic absences for this Magnetic Space Group via

Magnetic Point Group: m'm2' (7.3.22)
    [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 typexyzOccupancyMultiplicitySymmetry constraints on MMxMyMz|M|
Mn1Mn0.75000-0.006000.866500.58134mx,my,mz0.00.01.471.47
Mn2Mn0.000000.506000.133500.581320,my,mz0.00.0-1.471.47
Mn3Mn0.500000.506000.133500.581320,my,mz0.00.01.471.47
Co1Co0.75000-0.006000.866500.41874mx,my,mz0.00.01.471.47
Co2Co0.000000.506000.133500.418720,my,mz0.00.0-1.471.47
Co3Co0.500000.506000.133500.418720,my,mz0.00.01.471.47

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



Active Irreps:                                           
Irrep decomposition via


labeldim. full irrepdim. small irrepdirectionactionnumber of modespresence
mGM2+ 1 1 primary? 4 yes
mGM4- 1 1 primary? 4 yes
mY2 2 2 special primary 6


Comments:
Comments (symmetry):

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