Christopher S. Drew, University of Nottingham

Semiclassical transmission across multidimensional barriers.

The reaction probability in chemical reactions can be calculated from the quantum mechanical scattering operator. A phase space representation of the scattering operator is considered and illustrated numerically using a two-dimensional waveguide model of a collinear atom-diatom reaction. We consider two methods for approximating this phase space representation semiclassically using complexified trajectories through the waveguide. Firstly a method that uses the linearised dynamics and so is only valid for a small region of phase-space but is uniformally valid across the barrier energy. Secondly a more involved non-linear method that is valid over a larger region of phase space and shows significantly improved numerical agreement.