DFT study of the hydrogen adsorption and storage on Ni4 cluster embedded in multivacancy graphene
V. Orazi, R.E. Ambrusi, J.M. Marchetti, M.E. Pronsato
Topics & Concepts
AdsorptionHydrogen storageGraphenevan der Waals forceDensity functional theoryMoleculeChemical physicsHydrogenCluster (spacecraft)Hydrogen bondMaterials scienceChemistryPhysical chemistryComputational chemistryNanotechnologyOrganic chemistryProgramming languageComputer scienceHydrogen Storage and MaterialsGraphene research and applicationsNanomaterials for catalytic reactions