Study of electronic structure, stabilities and electron localization behavior of AgPbn (n=1–14) nanoclusters: A first principal investigation
Ravi Trivedi, Antara Banerjee, Debashis Bandyopadhyay
Topics & Concepts
NanoclustersElectron localization functionDensity functional theoryElectronChemical stabilityFukui functionMolecular physicsHOMO/LUMOChemical bondFragmentation (computing)ChemistryDensity of statesChemical physicsElectronic structureAtomic physicsMaterials sciencePhysicsMoleculeComputational chemistryCondensed matter physicsNanotechnologyQuantum mechanicsComputer scienceOrganic chemistryBiochemistryElectrophileCatalysisOperating systemnanoparticles nucleation surface interactionsAdvanced Chemical Physics StudiesFullerene Chemistry and Applications