T. Hoche et al., HIGH-RESOLUTION TRANSMISSION ELECTRON-MICROSCOPY STUDIES OF A NEAR SIGMA-11 GRAIN-BOUNDARY IN ALPHA-ALUMINA, Journal of the American Ceramic Society, 77(2), 1994, pp. 339-348
The atomistic structure of a near Sigma 11 (N Sigma 11) grain boundary
in ultrapure alpha-Al2O3 bicrystals was determined by quantitative hi
gh-resolution transmission electron microscopy (HRTEM). High-resolutio
n imaging revealed an atomically sharp interface with a characteristic
periodic pattern at (0 $($) over bar$$ 111) parallel to (01 $$($) ove
r bar 11) facets. The pattern was analyzed by comparing the HRTEM micr
ographs with simulated images of different structures that had been re
laxed by static-lattice calculations. The best agreement with experime
nt was reached for the grain boundary structure with the lowest energy
(1.7 J.m(-2)). Although this structure reproduces the relative transl
ation state of the adjacent crystals to within 0.02 nm, the calculated
structure was not in complete agreement with the periodic pattern at
the grain boundary. The origin of this difference is probably due to a
slight misalignment of the two crystals adjacent to the boundary.