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Characterization of the Methane-Graphene Hydrophobic Interaction in Aqueous Solution from Ab Initio Simulations

C Calero1, J Martí1, E Guàrdia1

  • 1Departament de Física i Enginyeria Nuclear, Universitat Politècnica de Catalunya-Barcelona Tech , B5-209 Campus Nord., 08034 Barcelona, Spain.

Journal of Chemical Theory and Computation
|November 20, 2015
PubMed

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