Stable hydrogenated graphene edge types: Normal and reconstructed Klein edges

Hydrogenated graphene edges are assumed to be either armchair, zigzag or a combination of the two. We show that the zigzag is not the most stable fully hydrogenated structure along the <2-1-10> direction. Instead hydrogenated Klein and reconstructed Klein based edges are found to be energetica...

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Detalhes bibliográficos
Autor principal: Wagner, Philipp (author)
Outros Autores: Ivanovskaya, Viktoria V. (author), Melle-Franco, M. (author), Humbert, Bernard (author), Adjizian, Jean-Joseph (author), Briddon, P. R. (author), Ewels, Christopher P. (author)
Formato: article
Idioma:eng
Publicado em: 2013
Assuntos:
Graphene
Graphene edges
Ciências Naturais::Ciências Físicas
Science & Technology
Texto completo:http://hdl.handle.net/1822/31413
País:Portugal
Oai:oai:repositorium.sdum.uminho.pt:1822/31413

Texto Completo

http://hdl.handle.net/1822/31413

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