J. Nowotny et M. Rekas, DEFECT STRUCTURE, ELECTRICAL-PROPERTIES AND TRANSPORT IN BARIUM-TITANATE .6. GENERAL DEFECT MODEL, Ceramics international, 20(4), 1994, pp. 257-263
Electrical conductivity data are analysed in terms of defect equilibri
a for undoped BaTiO3 within a wide range of temperatures and oxygen pa
rtial pressures. Based on the Hall effect data reported by Seuter the
equilibrium constants of the formation of (1) oxygen vacancies (K1), (
2) Schottky disorder and (3) intrinsic disorder (K(i)) were determined
. The defect diagram of BaTiO3 thus derived involves four regimes of d
ifferent charge neutrality. The effect of doping with aliovalent ions
on the concentration of intrinsic defects was also determined. It was
shown that the validity of the extrinsic disorder is limited to the n-
type regime. It has been argued that any model constructed in the p-ty
pe regime cannot ignore the formation of cation vacancies. A defect mo
del based on a general charge neutrality was derived. The model is val
id within a wide range of compositions involving both n- and p-type re
gimes, except extremely reducing conditions. The resulting defect diag
rams indicate that Schottky-type defect structure predominates in undo
ped BaTiO3 in the p-type regime.