| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 1562488 | Computational Materials Science | 2011 | 4 Pages |
Abstract
⺠The structural and electronic properties of superhard BC5 are studied theoretically. ⺠P3m1-II structure is confirmed as the most stable state of BC5 by comparing three potential structures. ⺠The compressibility of BC5 along three cell vectors is very close to each other. ⺠High pressure hardly change the DOS at Fermi level (EF) which is related closely to the transition temperature Tc.
Keywords
Related Topics
Physical Sciences and Engineering
Engineering
Computational Mechanics
Authors
Ji-Dong Zhang, Xin-Lu Cheng,