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Three applications of path integrals: equilibrium and kinetic isotope effects, and the temperature dependence of the rate constant of the [1,5] sigmatropic hydrogen shift in (Z)-1,3-pentadiene

Journal of Molecular Modeling, 2010, Vol.16(11), pp.1779-1787 [Peer Reviewed Journal]

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by this Author/Contributor:

  1. Vaníček, J.
  2. Zimmermann, Tomáš
  3. Vaníček, Jiří
  4. Zimmermann, T.

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