Bulletin of the Korean Chemical Society

Korean Chemical Society (대한화학회)
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Thermodynamics of Small Electron-Bound Water Clusters

  • Lee, Sik (Center for Computational Biology and Bioinformatics, Korea Institute of Science and Technology Information) ;
  • Lee, Han-Myoung (Center for Superfunctional Materials, Department of Chemistry, Pohang University ofScience and Technology)
  • Published : 2003.06.20
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Abstract

The relative stabilities of weak binding clusters are sensitive to temperature due to the entropy effect. Thus, here we report significant changes in relative stabilities between two low-energy electron-water trimer structures and those between three low-energy electron-water pentamer structures, as the temperature increases. The trimer and pentamer show structural changes around 200 K.

Keywords

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