Potential new candidates for hard materials within the ternary XC3N3 (X = B, Al, Ga) stoichiometry
Language
en
Article de revue
This item was published in
Comptes Rendus. Chimie. 2004, vol. 7, n° 5, p. 529-535
Académie des sciences (Paris)
English Abstract
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 ...Read more >
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 the 2nd- and 3rd-period elements Al and Ga...Read less <
English Keywords
Hard materials
Light elements
Compressebility modulus
DFT
LDA
US-PP
ELF
Origin
Hal imported