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  • 标题:Probing the transition state via photoelectron and photodetachment spectroscopy of H3O−
  • 本地全文:下载
  • 作者:Dong H. Zhang ; Minghui Yang ; Michael A. Collins
  • 期刊名称:Proceedings of the National Academy of Sciences
  • 印刷版ISSN:0027-8424
  • 电子版ISSN:1091-6490
  • 出版年度:2002
  • 卷号:99
  • 期号:18
  • 页码:11579-11582
  • DOI:10.1073/pnas.182297599
  • 语种:English
  • 出版社:The National Academy of Sciences of the United States of America
  • 摘要:The H3O- anion has stable and metastable structures that resemble configurations in the vicinity of the transition state for the neutral reactions OH + H2 {leftrightarrow} H2O + H. Photoelectron spectroscopy of this anion probes the neutral reaction dynamics in the critical transition-state region. Accurate quantum dynamics calculations of the photoelectron intensity and photodissociation product energies are shown to provide a quantitatively reliable means of interpreting such experimental observations and reveal a detailed picture of the reaction dynamics.
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