• Title of article

    Forward–backward propagation in the mixed quantum–classical theory for the collisional energy transfer

  • Author/Authors

    Ivanov، نويسنده , , Mikhail V. and Babikov، نويسنده , , Dmitri، نويسنده ,

  • Issue Information
    روزنامه با شماره پیاپی سال 2012
  • Pages
    4
  • From page
    173
  • To page
    176
  • Abstract
    A method of forward–backward propagation is incorporated into the mixed quantum–classical theory for calculations of the collisional energy transfer and ro-vibrational energy flow in a molecule + quencher encounter. This permits to avoid unphysical behavior of the energy transfer function in the range of large impact parameters. A case study is presented on stabilization of the metastable states of ozone in collisions with Ar bath gas.
  • Journal title
    Chemical Physics Letters
  • Serial Year
    2012
  • Journal title
    Chemical Physics Letters
  • Record number

    1933096