Towards a new class of computationally predicted carbon-based two-dimensional nanomaterials: a density functional theory (DFT) study on alkaline earth doped graphene for oxygen reduction/evolution reaction (ORR/OER) mechanisms

Towards a new class of computationally predicted carbon-based two-dimensional nanomaterials: a density functional theory (DFT) study on alkaline earth doped graphene for oxygen reduction/evolution reaction (ORR/OER) mechanisms

Detalhes bibliográficos
Autor principal: Serraon, Ace Christian F. (Autor)
Outros Autores: Ocon, Joey D. (adviser.), Padama, Allan Abraham B. (adviser.)
Formato: Tese
Idioma:English
Publicado em: Quezon City College of Engineering, University of the Philippines Diliman 2019.
Assuntos:
Density functionals.
Electronic structure.
Acesso em linha:Abstract