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First‐Principle‐Based Phonon Transport Properties of Nanoscale Graphene Grain Boundaries

The integrity of phonon transport properties of large graphene (linear and curved) grain boundaries (GBs) is investigated under the influence of structural and dynamical disorder. To do this, density functional tight‐binding (DFTB) method is combined with atomistic Green's function technique. T...

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Detalles Bibliográficos
Autores principales: Sandonas, Leonardo Medrano, Sevinçli, Hâldun, Gutierrez, Rafael, Cuniberti, Gianaurelio
Formato: Online Artículo Texto
Lenguaje:English
Publicado: John Wiley and Sons Inc. 2018
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5827104/
https://www.ncbi.nlm.nih.gov/pubmed/29619296
http://dx.doi.org/10.1002/advs.201700365