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Phonon properties of graphene derived from molecular dynamics simulations
A method that utilises atomic trajectories and velocities from molecular dynamics simulations has been suitably adapted and employed for the implicit calculation of the phonon dispersion curves of graphene. Classical potentials widely used in the literature were employed. Their performance was asses...
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| Publicado no: | Sci Rep |
|---|---|
| Main Authors: | , , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
Nature Publishing Group
2015
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC4551956/ https://ncbi.nlm.nih.gov/pubmed/26316252 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/srep12923 |
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