ArticlePhilosophical transactions. Series A, Mathematical, physical, and engineering sciences2017
Kinetics of low-temperature transitions and a reaction rate theory from non-equilibrium distributions.
Article in Philosophical transactions. Series A, Mathematical, physical, and engineering sciences, 2017. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 12 papers.
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12 citing papers in PubMed.
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- On the Dynamics of the Carbon-Bromine Bond Dissociation in the 1-Bromo-2-Methylnaphthalene Radical Anion.Molecules (Basel, Switzerland) · 2022Article
- Study of deactivation in mesocellular foam carbon (MCF-C) catalyst used in gas-phase dehydrogenation of ethanol.Scientific reports · 2021Article
- Temperature effect on water dynamics in tetramer phosphofructokinase matrix and the super-arrhenius respiration rate.Scientific reports · 2021Article
- From the Kinetic Theory of Gases to the Kinetics of Rate Processes: On the Verge of the Thermodynamic and Kinetic Limits.Molecules (Basel, Switzerland) · 2020Article
- Kinetics of Methyl Lactate Formation from the Transesterification of Polylactic Acid Catalyzed by Zn(II) Complexes.ACS omega · 2020Article
- "Transitivity": A Code for Computing Kinetic and Related Parameters in Chemical Transformations and Transport Phenomena.Molecules (Basel, Switzerland) · 2019Article
- Nucleophilic substitution vs elimination reaction of bisulfide ions with substituted methanes: exploration of chiral selectivity by stereodirectional first-principles dynamics and transition state theory.Journal of molecular modeling · 2019Article
- Beyond Boltzmann-Gibbs-Shannon in Physics and Elsewhere.Entropy (Basel, Switzerland) · 2019Review
- Temperature Dependence of Rate Processes Beyond Arrhenius and Eyring: Activation and Transitivity.Frontiers in chemistry · 2019Article
- Theoretical and computational studies of non-equilibrium and non-statistical dynamics in the gas phase, in the condensed phase and at interfaces.Philosophical transactions. Series A, Mathematical, physical, and engineering sciences · 2017Article
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3 authors.
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Abstract
This article surveys the empirical information which originated both by laboratory experiments and by computational simulations, and expands previous understanding of the rates of chemical processes in the low-temperature range, where deviations from linearity of Arrhenius plots were revealed. The phenomenological two-parameter Arrhenius equation requires improvement for applications where interpolation or extrapolations are demanded in various areas of modern science. Based on Tolman's theorem, the dependence of the reciprocal of the apparent activation energy as a function of reciprocal absolute temperature permits the introduction of a deviation parameter
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