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...

Полное описание

Библиографические подробности
Главные авторы: Milman, V, Warren, M
Формат: Journal article
Язык:English
Опубликовано: IOP 2001