2 papers
cond-mat.mtrl-sci2019
Altering the reactivity of pristine, N- and P-doped graphene by strain engineering: a DFT view on energy related aspects
Ana S. Dobrota, Igor A. Pašti, Slavko V. Mentus +2
For carbon-based materials, in contrast to metal surfaces, the relationship between strain and reactivity is not yet established, even though there are literature reports on strain…
cond-mat.mtrl-sci2018
Sodium storage via single epoxy group on graphene - The role of surface doping
Nataša P. Diklić, Ana S. Dobrota, Igor A. Pašti +3
Due to its unique physical and chemical properties, graphene is being considered as a promising material for energy conversion and storage applications. Introduction of functional…