Site-specific polarizabilities as descriptors of metallic behavior in atomic clusters

ORAL

Abstract

The electric dipole polarizability of a cluster is a measure of its response to an applied electric field. The site specific polarizability method decomposes the total cluster polarizability into contributions from individual atoms and also allows it to be partitioned into charge transfer and electric dipole contributions. By systematically examining the trends in these quantities for several types of metal atom clusters over a wide range of cluster sizes, we find common characteristics that uniquely link the behavior of the clusters to that of the corresponding bulk metals for clusters as small as 10 atoms. We discuss these trends and compare and contrast them with results for non-metal clusters.

Authors

  • Koblar Jackson

    Physics Department and Science of Advanced Materials Ph.D. Program, Central Michigan University

  • Julius Jellinek

    Chemical Sciences and Engineering Division, Argonne National Laboratory, CSE division, Argonne National Laboratory