Potential new candidates for hard materials within the ternary XC3N3 (X = B, Al, Ga) stoichiometry
Langue
en
Article de revue
Ce document a été publié dans
Comptes Rendus. Chimie. 2004, vol. 7, n° 5, p. 529-535
Académie des sciences (Paris)
Résumé en anglais
Starting from formerly investigated graphitic like C3N4, selective substitution of nitrogen with boron led to model structures for the experimentally observed BC3N3 stoichiometry. Similar investigations were extended to ...Lire la suite >
Mots clés en anglais
Hard materials
Light elements
Compressebility modulus
DFT
LDA
US-PP
ELF