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...

Olles dieđut

Bibliográfalaš dieđut
Váldodahkki: Kamenski, P
Eará dahkkit: Pettifor, D
Materiálatiipa: Oahppočájánas
Giella:English
Almmustuhtton: 2011
Fáttát: