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

Bibliografski detalji
Glavni autor: Serraon, Ace Christian F. (Autor)
Daljnji autori: Ocon, Joey D. (adviser.), Padama, Allan Abraham B. (adviser.)
Format: Disertacija
Jezik:English
Izdano: Quezon City College of Engineering, University of the Philippines Diliman 2019.
Teme:
Density functionals.
Electronic structure.
Online pristup:Abstract