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Efficient Structural Relaxation of Polycrystalline Graphene Models

Large samples of experimentally produced graphene are polycrystalline. For the study of this material, it helps to have realistic computer samples that are also polycrystalline. A common approach to produce such samples in computer simulations is based on the method of Wooten, Winer, and Weaire, ori...

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Detalles Bibliográficos
Autores principales: D’Ambrosio, Federico, Barkema, Joris, Barkema, Gerard T.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8151425/
https://www.ncbi.nlm.nih.gov/pubmed/34066793
http://dx.doi.org/10.3390/nano11051242

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