In this paper new multi-temperature models for rate coefficients of non-equilibrium chemical reactions in mixtures containing CO2 molecules are derived on the basis of the kinetic theory. The models are obtained by averaging of state-dependent reaction rate coefficients, found previously, over multi-temperature vibrational distributions. Five-temperature, three-temperature and two-temperature non-equilibrium distributions are considered and comparison of reaction rate coefficients derived using these distributions as well as the thermal equilibrium one-temperature model is presented. The proposed rate coefficients are used in the governing equations for vibrational and chemical relaxation in the five-component mixture CO2/CO/O2/C/O. The solution of these equations is obtained in the five-temperature, three-temperature, two-temperature and one-temperature approaches. Finally, the influence of chemical reaction models on macroscopic mixture parameters is discussed in the paper.
Original languageEnglish
Article number110718
Number of pages9
JournalChemical Physics
Volume533
Early online date21 Feb 2020
DOIs
StatePublished - 1 May 2020

    Research areas

  • Thermochemical non-equilibrium, Chemical reactions, Carbon dioxide

    Scopus subject areas

  • Physics and Astronomy(all)
  • Physical and Theoretical Chemistry

ID: 51826022