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Theoretical Studies on the Electronic and Optical Properties of Honeycomb BC(3) monolayer: A Promising Candidate for Metal-free Photocatalysts

[Image: see text] By employing first-principles computations and particle-swarm optimization calculations, we theoretically confirmed the honeycomb geometry of experimentally realized BC(3) sheet, which is constructed by the hexagonal carbon-ring fragments surrounded by six boron atoms and has prono...

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Detalles Bibliográficos
Autores principales:	Zhang, Haijun, Liao, Yunlong, Yang, Guang, Zhou, Xiaomeng
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	American Chemical Society 2018
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6645329/ https://www.ncbi.nlm.nih.gov/pubmed/31459177 http://dx.doi.org/10.1021/acsomega.8b01998

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