| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 10653406 | Solid State Communications | 2005 | 4 Pages |
Abstract
The phase transformation of GaN under high pressure is theoretically studied in the KS-DFT framework using the EXX method. Both KLI and LDA pseudopotentials were tried. The LDA-PP result for the transition pressure is 41.7Â GPa while that of the KLI-PP is 41.5Â GPa. Both results are in a very good agreement with the latest experimental value of 42Â GPa. The effect of the nonlinear core correction is found to be small but not negligible.
Related Topics
Physical Sciences and Engineering
Materials Science
Materials Science (General)
Authors
A.I. Al-Sharif,