Semiclassical calculation of collisional dissociation cross sections for N¿N2

نویسندگان

  • Catherine Tully
  • Robert E. Johnson
چکیده

Dissociation and doubly differential cross sections are calculated for N1N2 at near-threshold collision energies using a semiclassical wave packet method in which the vibrational motion of the molecule is treated quantum mechanically and the rotational and translational motions are treated classically. A three-bodied London–Eyring–Polanyi–Sato potential energy surface is used and results compared to those obtained using a purely repulsive power law potential. For a comparison of results, cross sections are also calculated using pure classical mechanics. © 2002 American Institute of Physics. @DOI: 10.1063/1.1504085#

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تاریخ انتشار 2002