The Journal of Chemical Physics · 2006 · 68 citations · 49 references
EngineeringNanoclusterPacked StructuresComputational ChemistryIon Electron DiffractionChemistryIcosahedral MotifAnalytical ChemistryElemental CharacterizationMaterials ScienceInorganic ChemistryCluster ScienceSilver Cluster IonsAtomic PhysicsPhysical ChemistryQuantum ChemistryCrystallographyCrystal Structure DesignNatural SciencesSpectroscopyCluster ChemistryIon Structure
The structures of mass selected silver cluster cations Ag19 +, Ag38 +, Ag55 +, Ag59 +, Ag75 +, and Ag79 + have been probed at a temperature of 100 K by trapped ion electron diffraction. The structure assignment is carried out by comparison of the experimental scattering intensity with theoretical scattering functions of calculated candidate structures obtained by density functional theory. For the cluster sizes studied the resulting experimental data are invariably best described by structures based on the icosahedral motif, while closed packed structures can be ruled out.
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Jianmin Tao, John P. Perdew, Viktor N. Staroverov et al. · Physical Review Letters · 2003 · 6.9K citations · Full text
Engineering, Density Functional Ladder, Magnetic Resonance +16