Analysis of single-crystal Mossbauer data in low-symmetry <sup>57</sup>Fe centres
W C Tennant; W C Tennant; New Zealand Inst. for Ind. Res. & Dev., Wellington, New Zealand
Журнал:
Journal of Physics: Condensed Matter
Дата:
1992-08-17
Аннотация:
The Mossbauer single-crystal experiment is discussed with particular reference to the low-symmetry resonant sites. It is demonstrated that ambiguities associated with multiple, symmetry-related resonant sites (that is, sites whose Laue class is lower than that of the host crystal) are resolvable provided the absorber recoilless fractions can be precisely measured. A general computer program, MOSREF, is described that enables simulation of single-crystal spectra and/or refinement of Mossbauer parameters for a <sup>57</sup>Fe centre in a site of any known symmetry in a host crystal of any known symmetry. The procedures are illustrated for a couple of ideal examples: a triclinic site in a monoclinic crystal and a monoclinic site in a trigonal crystal. Applications to recent experiments with the sheet micas biotite and muscovite are given.
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