Cargando…
Effect of Passivation on Stability and Electronic Structure of Bulk-like ZnO Clusters
[Image: see text] Electronic structure of nearly stoichiometric and nonstoichiometric clusters of ZnO having bulk-like wurtzite geometry passivated with fictitious hydrogen atoms are comparatively analyzed for structural evolution using density functional theory-based electronic structure calculatio...
| Autores principales: | , , |
|---|---|
| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2018
|
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6644822/ https://www.ncbi.nlm.nih.gov/pubmed/31458919 http://dx.doi.org/10.1021/acsomega.8b00998 |