S. Swaminathan et al., EFFECTS OF DEBYE-WALLER FACTORS AND COMPOSITIONAL UNCERTAINTIES ON THE 200 STRUCTURE FACTOR REFINEMENT IN GAMMA-TIAL, Philosophical magazine letters, 75(5), 1997, pp. 261-270
The effects of uncertainties in Debye-Waller factors and chemical comp
osition on 200 structure factor refinement in gamma-TiAl have been inv
estigated. Energy-filtered convergent-beam electron diffraction has be
en used to record 200 rocking curves from two different thicknesses of
a thin foil taken from a Ti-51.3 +/- 1 Al alloy (all compositions in
atomic per cent). The structure factor has been refined by matching ro
cking curves determined by experiment to those theoretically calculate
d using the Bloch wave formalism of the dynamical theory of electron d
iffraction. The influence of uncertainties in the Debye-Waller factors
and sample composition have been assessed: for samples deviating from
stoichiometry, the need to use accurate site-specific Debye-Waller fa
ctors has been demonstrated. Also, to extract accurate structure facto
rs, it is necessary to make use of homogeneous samples, the compositio
ns of which must be known to better than +/-0.2%, a rather restrictive
limitation.