4.6 Article

The Growth of Ionic Crystals Based on the Halogenation of Copper Cluster Anions

Journal

JOURNAL OF PHYSICAL CHEMISTRY A
Volume 116, Issue 9, Pages 2012-2017

Publisher

AMER CHEMICAL SOC
DOI: 10.1021/jp211636r

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Funding

  1. Air Force Office of Scientific Research under AFOSR [FA 9550-08-1-0400]

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We investigated the halogenation reactivity of copper cluster anions produced via a magnetron-sputter source after introduction into a fast-flow tube reaction apparatus simultaneously with chlorine gas. Interesting cluster products corresponding to [CunCln+1](-) (n = 1-6) were observed with notable stability, and the mass distribution of these clusters exhibits an exponential decay with increasing values of n. Reaction kinetics analysis is provided on the gas-phase reactivity of copper cluster anions with chlorine. First-principle calculations suggest a series of cubic-like structures for these species similar to the structure of alkali halide clusters due to their similar electronic configurations. These structures act as a starting point in the formation of ionic crystals.

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