Electron localization in clusters

Uzi Landman, R. N. Barnett, C. L. Cleveland, Dafna Scharf, Joshua Jortner

Research output: Contribution to journalArticlepeer-review

Abstract

The quantum path integral molecular dynamics method was utilized to explore the compositional, structural, and size dependence of localization mode of an excess electron in ionic and hydrogen‐bonded clusters, providing information on the nature of surface states and on isomerization induced by electron attachment in large finite systems.

Original languageEnglish
Pages (from-to)573-587
Number of pages15
JournalInternational Journal of Quantum Chemistry
Volume32
Issue number21 S
DOIs
StatePublished - 12 Mar 1987

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