most citedA Computational Investigation of the Catalytic Properties of Graphene Oxide: Exploring Mechanisms Using DFT Methods

148 citations · 148 across the 1 of their papers we have counts for

collaborators

1 paper

cond-mat.mtrl-sci2012★ 148 cited

A Computational Investigation of the Catalytic Properties of Graphene Oxide: Exploring Mechanisms Using DFT Methods

Danil W. Boukhvalov, Daniel R. Dreyer, Christopher W. Bielawski +1

Here we describe a computational study undertaken in an effort to elucidate the reaction mechanisms behind the experimentally observed oxidations and hydrations catalyzed by graphe…