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  • 1
    Electronic Resource
    Electronic Resource
    Copenhagen : International Union of Crystallography (IUCr)
    Applied crystallography online 32 (1999), S. 290-295 
    ISSN: 1600-5767
    Source: Crystallography Journals Online : IUCR Backfile Archive 1948-2001
    Topics: Geosciences , Physics
    Notes: Anisotropic strain broadening in X-ray or neutron powder diffraction can cause severe difficulties in whole powder-pattern fitting and Rietveld structure refinement. Several phenomenological models have been proposed to deal with this problem. These, however, lack physically sound bases. In the present work the dislocation-based model of strain anisotropy is applied in the Fourier formalism of profile fitting. It is shown that the anisotropic contrast of dislocations can fully account for strain anisotropy. A few physically sound parameters, namely the average dislocation density, the average coherent domain size, the dislocation arrangement parameter and the dislocation contrast factors, enable a perfect profile fitting to the powder pattern of a cubic Li–Mn spinel obtained at the Daresbury synchrotron storage ring.
    Type of Medium: Electronic Resource
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  • 2
    Electronic Resource
    Electronic Resource
    Copenhagen : International Union of Crystallography (IUCr)
    Applied crystallography online 32 (1999), S. 1186-1189 
    ISSN: 1600-5767
    Source: Crystallography Journals Online : IUCR Backfile Archive 1948-2001
    Topics: Geosciences , Physics
    Notes: The structural evolution of LiMn2O4 spinel was followed from 320 K down to 10 K. The structural transformation, recently studied down to 230 K [Rodriguez-Carvajal, Rousse, Masquelier & Hervieu (1998). Phys. Rev. Lett. 81, 4660–4663], takes place near room temperature with a significant hysteresis: the high-temperature cubic phase transforms to a superstructure orthorhombic cell. The present study indicates that the nuclear structure is stable down to 10 K, while neutron diffraction patterns below 80 K show the rise of a magnetic ordering in the spinel phase. From Mn—O bond-length analysis of the MnO6 octahedra, a temperature-independent charge ordering in the structure can be deduced.
    Type of Medium: Electronic Resource
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