First-principles characterisation of new ternary heterodiamond BC2N phases

Computational Materials Science

Volumn 20, Issue 1, 2001, Pages 107-119

  Mattesini, Maurizio ^a   Matar, Samir F ^a  

^a INST CHIM MATIERE COND BORDEAUX   (France)

Author keywords

Boron carbonitrides; Bulk modulus; DFT; Elastic properties; Hardness; LDA; Shear modulus; Ultrahard materials

Indexed keywords

DIAMONDS; ELASTIC MODULI; GROUND STATE; HARDNESS; LINEARIZATION;

BORON CARBONITRIDES; FIRST-PRINCIPLES METHOD;

BORON COMPOUNDS;

EID: 0034919594     PISSN: 09270256     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0927-0256(00)00132-4     Document Type: Article

References (55)

1. WIEN97