Abstract
We have theoretically investigated the mechanism of the reconstructive wurtzite-to-rocksalt phase transition. Using COMSUBS, we found five different bond-preserving transitions pathways. These transition paths share a common underlying mechanism: bilayer sliding of (010) hexagonal planes along the [100] hexagonal directions.
- Received 22 March 2007
DOI:https://doi.org/10.1103/PhysRevB.76.012102
©2007 American Physical Society