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American Physical Society, Physical Review Letters, 22(95), 2005

DOI: 10.1103/physrevlett.95.223001

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Semiclassical Scattering on Conical Intersections

Journal article published in 2005 by Andrei Piryatinski, Misha Stepanov, Sergei Tretiak ORCID, Vladimir Chernyak
This paper is available in a repository.
This paper is available in a repository.

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Abstract

We apply a semiclassical approach to the scattering problem of a vibrational wave packet in the vicinity of a conical intersection of electronic energy surfaces and derive analytical expressions for the scattering matrix. The latter are valid when the scattering length that scales as square root(h) is small and a wave packet passes through the scattering region with a constant velocity. The analytical results are in excellent agreement with numerical simulations for a realistic set of parameters.