Elasticity of hexagonal BeO

We study the elastic properties, electronic structure, and equation of state of BeO using a first-principles pseudopotential method within the gradient-corrected approximation of the density functional theory. Comparison of the calculated and experimental properties of BeO shows good agreement for a...

Disgrifiad llawn

Manylion Llyfryddiaeth
Prif Awduron: Milman, V, Warren, M
Fformat: Journal article
Iaith:English
Cyhoeddwyd: IOP 2001