Detailed analysis of charge transport in amorphous organic thin layer by multiscale simulation without any adjustable parameters

Hopping-type charge transport in an amorphous thin layer composed of organic molecules is simulated by the combined use of molecular dynamics, quantum chemical, and Monte Carlo calculations. By explicitly considering the molecular structure and the disordered intermolecular packing, we reasonably re...

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Detalles Bibliográficos
Autores principales: Uratani, Hiroki, Kubo, Shosei, Shizu, Katsuyuki, Suzuki, Furitsu, Fukushima, Tatsuya, Kaji, Hironori
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group 2016
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5175281/
https://www.ncbi.nlm.nih.gov/pubmed/28000728
http://dx.doi.org/10.1038/srep39128

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5175281/
https://www.ncbi.nlm.nih.gov/pubmed/28000728
http://dx.doi.org/10.1038/srep39128

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