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Modeling of BN-Doped Carbon Nanotube as High-Performance Thermoelectric Materials

Ternary BNC nanotubes were modeled and characterized through a periodic density functional theory approach with the aim of investigating the influence on the structural, electronic, mechanical, and transport properties of the quantity and pattern of doping. The main energy band gap is easily tunable...

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Detalles Bibliográficos
Autores principales: Marana, Naiara L., Sambrano, Julio R., Casassa, Silvia
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9737904/
https://www.ncbi.nlm.nih.gov/pubmed/36500966
http://dx.doi.org/10.3390/nano12234343