Equibiaxial Strained Oxygen Adsorption on Pristine Graphene, Nitrogen/Boron Doped Graphene, and Defected Graphene

We report first-principles calculations on the structural, mechanical, and electronic properties of O(2) molecule adsorption on different graphenes (including pristine graphene (G–O(2)), N(nitrogen)/B(boron)-doped graphene (G–N/B–O(2)), and defective graphene (G–D–O(2))) under equibiaxial strain. Ou...

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Detalles Bibliográficos
Autores principales: Qu, Li-Hua, Fu, Xiao-Long, Zhong, Chong-Gui, Zhou, Peng-Xia, Zhang, Jian-Min
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2020
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7684466/
https://www.ncbi.nlm.nih.gov/pubmed/33158010
http://dx.doi.org/10.3390/ma13214945

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