73 citations · 513 across the 21 of their papers we have counts for
Showing 2017 · physics.chem-phShow all
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physics.chem-ph2017★ 49 cited
Nonadiabatic semiclassical dynamics in the mixed quantum-classical initial value representation
Matthew S. Church, Timothy J. H. Hele, Gregory S. Ezra +1
We extend the Mixed Quantum-Classical Initial Value Representation (MQC-IVR), a semiclassical method for computing real-time correlation functions, to electronically nonadiabatic s…
physics.chem-ph2017★ 8 cited
Dynamics on the Double Morse Potential: A Paradigm for Roaming Reactions with no Saddle Points
Barry K. Carpenter, Gregory S. Ezra, Stavros C. Farantos +2
In this paper we analyze a two degree of freedom Hamiltonian system constructed from two planar Morse potentials. The resulting potential energy surface has two potential wells sur…