• State-to-state chemistry: Anab initio approach

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      https://www.ias.ac.in/article/fulltext/jcsc/093/03/0449-0457

    • Keywords

       

      State-to-state reaction; reactive scattering; inelastic scattering; atom-diatom collisions

    • Abstract

       

      It has become possible in recent years to compute state-to-state reaction crosssections and rate constants from first principles for a few elementary chemical reactions and for a few energy transfer processes. We illustrate the state-of-the art using examples of results obtained from our own laboratory.

    • Author Affiliations

       

      N Sathyamurthy1

      1. Department of Chemistry, Indian Institute of Technology, Kanpur - 208016, India
    • Dates

       
  • Journal of Chemical Sciences | News

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