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Phase stability limit of c-BN under hydrostatic and non-hydrostatic pressure conditions.

Authors :
Jianwei Xiao
Jinglian Du
Bin Wen
Melnik, Roderick
Yoshiyuki Kawazoe
Xiangyi Zhang
Source :
Journal of Chemical Physics; 4/28/2014, Vol. 140 Issue 16, p164704-1-164704-7, 7p, 1 Chart, 4 Graphs
Publication Year :
2014

Abstract

Phase stability limit of cubic boron nitride (c-BN) has been investigated by the crystal structure search technique. It indicated that this limit is ~1000 GPa at hydrostatic pressure condition. Above this pressure, c-BN turns into a metastable phase with respect to rocksalt type boron nitride (rs-BN). However, rs-BN cannot be retained at 0 GPa owing to its instability at pressure below 250 GPa. For non-hydrostatic pressure conditions, the phase stability limit of c-BN is substantially lower than that under hydrostatic pressure conditions and it is also dramatically different for other pressure mode. [ABSTRACT FROM AUTHOR]

Details

Language :
English
ISSN :
00219606
Volume :
140
Issue :
16
Database :
Complementary Index
Journal :
Journal of Chemical Physics
Publication Type :
Academic Journal
Accession number :
95862370
Full Text :
https://doi.org/10.1063/1.4871897