Exploring transition state structures for intramolecular pathways by the artificial force induced reaction method

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Satoshi Maeda1, Tetsuya Taketsugu, Keiji Morokuma

  • 1Department of Chemistry, Faculty of Science, Hokkaido University, Sapporo, 060-0810, Japan.

Journal of Computational Chemistry
|November 5, 2013
PubMed

Keywords:
potential energy surface • transition state • reaction path • artificial force induced reaction

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