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Molecular Reaction Dynamics by Theory

简介 Dynamics/Spectroscopy/Kinetics/Mechanisms

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Quasi-Classical Trajectory Study of the HO + CO → H + CO2Reaction on a New ab Initio Based Potential Energy Surface

2012
期刊 The Journal of Physical Chemistry A
  • 卷 116
  • 期 21
  • 页码 5057-5067
  • American Chemical Society (ACS)
  • ISSN: 1089-5639
  • DOI: 10.1021/jp302278r