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physics.chem-ph2020★ 7 cited
Tuning the Branching Ratio in a Symmetric Potential Energy Surface with a Post-Transition State Bifurcation using External Time Dependence
V. J. García-Garrido, M. Katsanikas, M. Agaoglou +1
Chemical selectivity, as quantified by a branching ratio, is a phenomenon relevant for many organic chemical reactions. It may be exhibited on a potential energy surface that featu…
physics.chem-ph2020★ 29 cited
The Phase Space Mechanism for Selectivity in a Symmetric Potential Energy Surface with a Post-Transition-State Bifurcation
M. Agaoglou, V. J. Garcıa-Garrido, M. Katsanikas +1
Chemical selectivity is a phenomenon displayed by potential energy surfaces (PES) that is relevant for many organic chemical reactions whose PES feature a valley-ridge inflection p…