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:   

Cu6(SiO3)6(H2O)6 (#1.498)

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: O. Prokhnenko, G. Marmorini, S. E. Nikitin, D. Yamamoto, A. Gazizulina, M. Bartkowiak, A. N. Ponomaryov, S. A. Zvyagin, H. Nojiri, I. F. Díaz-Ortega, L. M. Anovitz, A. I. Kolesnikov, A. Podlesnyak, PHYSICAL REVIEW B (2021) 103 014427
DOI: 10.1103/PhysRevB.103.014427
Atomic positions from: ICSD #158571

Parent space group (paramagnetic phase): R-3 (#148)
Propagation vector: k1 (0, 0, 3/2)

Transition Temperature: 15 K
Experiment Temperature: 1.7 K

Lattice parameters of the magnetic unit cell:
14.59670 14.59670 15.59260 90.00 90.00 120.00
Transformation from parent structure: (a,b,2c;0,0,0)
    [View matrix form]

BNS Magnetic Space Group: RI-3 (#148.20) (non-standard)
    [View symmetry operations]
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: -3.1' (17.2.63)
    [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|
Cu1Cu0.995800.402580.0315236mx,my,mz0.108-0.054-0.630.65

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



Active Irreps:                                           
Irrep decomposition via


labeldim. small irrepdim. full irrepactionnumber of modes
mT1+ 1 1 primary 3


Comments:
Comments (symmetry):

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