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Coverage-dependent essential properties of halogenated graphene: A DFT study
The significant halogenation effects on the essential properties of graphene are investigated by the first-principles method. The geometric structures, electronic properties, and magnetic configurations are greatly diversified under the various halogen adsorptions. Fluorination, with the strong mult...
Guardat en:
| Publicat a: | Sci Rep |
|---|---|
| Autors principals: | , , , |
| Format: | Artigo |
| Idioma: | Inglês |
| Publicat: |
Nature Publishing Group UK
2017
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| Matèries: | |
| Accés en línia: | https://ncbi.nlm.nih.gov/pmc/articles/PMC5736697/ https://ncbi.nlm.nih.gov/pubmed/29259262 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/s41598-017-18170-8 |
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