Vy. Gertsman et al., GRAIN-BOUNDARY MISORIENTATION DISTRIBUTIONS IN MONOCLINIC ZIRCONIA, Modelling and simulation in materials science and engineering, 5(1), 1997, pp. 35-52
Possible grain boundary structures and distributions in monoclinic zir
conia are Crystallogeometrical analysis was employed to evaluate some
special, low-energy boundaries in the material. A computer simulation
was then used to model the grain boundary misorientation and character
distributions based on certain assumptions about crystallographic tex
ture and orientation correlations which influence the formation of low
-energy grain boundaries. The possible relevance of the results obtain
ed to optimization of the protective properties of zirconia films is d
iscussed.