R. Krachler et al., DIFFUSION MECHANISM AND DEFECT CONCENTRATIONS IN BETA'-FEAL, AN INTERMETALLIC COMPOUND WITH B2 STRUCTURE, Intermetallics, 3(1), 1995, pp. 83-88
A statistical thermodynamic model of the Wagner-Schottky type is appli
ed in order to determine the defect pattern in the beta'-FeAl phase. M
odel calculations based on the concentration dependence of the thermod
ynamic activity of Al yield the following defect concentrations for th
e composition Fe50.5Al49.5 at 1338 K: 176 +/- 0.20% of all lattice sit
es are vacant, 3.36 +/- 0.40% of the Al-sublattice sites are occupied
by Fe atoms, and 0.84 +/- 0.40%, of the Fe-sublattice sites are occupi
ed by Al atoms. The obtained concentration of anti-structure Fe atoms
is close to the number derived from Mossbauer spectroscopy studies whi
ch were carried out to determine the diffusion jump mechanism of Fe at
oms in the ordered alloy. Experimental results and model calculations
imply vacancies and anti-structure atoms on both sublattices. Therefor
e, although beta'-FeAl in principle belongs to the triple-defect B2-ty
pe, a certain degree of 'hybrid behaviour' must be taken into consider
ation.