Litcius/Paper detail

Organic contaminants and atmospheric nitrogen at the graphene–water interface: a simulation study

Ravindra Thakkar, Sandun Gajaweera, Jeffrey Comer

2022Nanoscale Advances12 citationsDOIOpen Access PDF

Abstract

, water, or aromatics. Taken together, these results suggest that ordered domains observed on graphene, graphite, and other hydrophobic materials in water are consistent with alkane-like molecules occupying the interface.

Topics & Concepts

GrapheneMonolayerNucleationChemical physicsMolecular dynamicsNitrogenAqueous solutionGraphiteMaterials scienceChemistryNanotechnologyPhysical chemistryOrganic chemistryComputational chemistryNanopore and Nanochannel Transport StudiesGraphene research and applicationsElectrostatics and Colloid Interactions