Orthogonal tight binding model for silicon carbide

A new orthogonal tight binding (OTB) model for the silicon carbide (Si-C) system is presented. The model is parameterized in the reduced TB form which provides a critical step towards the development of an analytic bond-order potential (BOP) for Si-C. Coarse-grained from density functional theory (D...

詳細記述

書誌詳細
第一著者: Kamenski, P
その他の著者: Pettifor, D
フォーマット: 学位論文
言語:English
出版事項: 2011
主題: