Enhanced thermoelectric properties in anthracene molecular device with graphene electrodes: the role of phononic thermal conductance

Density functional theory (DFT) and the non-equilibrium Green’s function (NEGF) formalism in the linear response regime were employed to investigate the impact of doping on the electronic and phononic transport properties in an anthracene molecule attached to two metallic zigzag graphene nanoribbons...

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Detalles Bibliográficos
Autores principales: Ramezani Akbarabadi, Saeideh, Rahimpour Soleimani, Hamid, Golsanamlou, Zahra, Bagheri Tagani, Maysam
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2020
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7331582/
https://www.ncbi.nlm.nih.gov/pubmed/32616835
http://dx.doi.org/10.1038/s41598-020-67964-w

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7331582/
https://www.ncbi.nlm.nih.gov/pubmed/32616835
http://dx.doi.org/10.1038/s41598-020-67964-w

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