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Growth morphology of perfect and twinned face-centered-cubic crystals by Monte Carlo simulation
Authors:Jae-Wook Lee   Nong M. Hwang  Doh-Yeon Kim
Affiliation:

Center for Microstructure Science of Materials, School of Materials Science and Engineering, Seoul National University, Bldg. 37, Room 106, Seoul 151-742, South Korea

Abstract:The effect of the relative growth rate between {1 1 1} and {1 0 0} faces on the growth morphology of perfect and twinned face-centered-cubic crystals was investigated with a Monte Carlo simulation considering both first-nearest-neighbor (FNN) and second-nearest-neighbor (SNN) interactions. When the bond energy ratio of SNN to FNN interactions is close to zero, the {1 1 1} twin planes make a reentrant edge, which enhances the growth rate on this plane, leading to a tabular growth shape. When the ratio is 0.25, the ridge side face of a tabular shape has the {1 0 0}/{1 0 0}/{1 1 1} structure instead of the {1 1 1}/{1 1 1} reentrant edge. In spite of disappearance of the reentrant edge, the side face has a higher growth rate than the top face because the {1 0 0} face still grows faster than the {1 1 1} face.
Keywords:A1. Crystal morphology   A1. Monte Carlo simulation   A1. Twin   A2. Crystal growth
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