Understanding and Application of Cubic Diamond and Hexagonal Diamond Structure
نویسندگان
چکیده
منابع مشابه
Structure and stability under pressure of cubic and hexagonal diamond crystals of C, BN and Si from first principles.
Application has been made of first-principles total-energy band-structure theory to find the equilibrium states under constant pressure of the super-hard cubic diamond (cd) and hexagonal diamond (hd) structures of carbon (C), boron nitride (BN) and medium-hard silicon (Si). The absolute stability of the equilibrium state is found by determinations of the breakdown under pressure of several defo...
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ژورنال
عنوان ژورنال: Daxue Huaxue
سال: 2021
ISSN: 1000-8438
DOI: 10.3866/pku.dxhx202101037