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

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CuF2 (#1.219)

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Magnetic structure with all atoms

Magnetic structure with only magnetic atoms


Reference: P. Fischer, W. Hälg, D. Schwarzenbach and H. Gamsjäger, Journal of Physics and Chemistry of Solids (1974) 35 1683-1689.
DOI: 10.1016/s0022-3697(74)80182-4
Atomic positions from: ICSD #9790

Parent space group (paramagnetic phase): P21/c (#14)
Propagation vector: k1 (1/2, 0, 0)

Transition Temperature: 69 K
Experiment Temperature: 4.2 K

Lattice parameters of the magnetic unit cell:
6.58800 4.56800 5.35800 90.00 121.17 90.00
Transformation from parent structure: (2a,b,c;0,0,0)
    [View matrix form]

BNS Magnetic Space Group: PS-1 (#2.7) (non-standard)
    [View symmetry operations]
Transformation to a standard setting: (-c,b,a;0,0,0)
    [View matrix form]
Systematic absences for this Magnetic Space Group via

Magnetic Point Group: -1.1' (2.2.4)
    [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|
Cu1_1Cu0.000000.000000.000002mx,my,mz0.26(9)0.68(3)0.00.73
Cu1_2Cu0.000000.500000.500002mx,my,mz-0.26-0.680.00.73

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



Active Irreps:                                           
Irrep decomposition via


labeldim. small irrepdim. full irrepactionnumber of modes
mY2+ 1 1 primary 3
mY1+ 1 1 primary 3


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Comments (symmetry):

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