Recent development of state-to-state quantum reactive scattering theory
Invited
Abstract
Development about efficient and accurate theory is fundamental problem in theoretical
chemistry field. To development new theories and improve the numerical efficiency for
calculating state-to-state quantum reactive scattering information using time-dependent quantum
wave packet method, plays an important role in molecular reaction dynamics field. In past
several years, we have developed several quantum reactive scattering theories, which are able to
accurately and efficiently calculate state-to-state reactive scattering differential cross sections, by
solving the long-standing so-called “coordinate problem”. For the first time, we would be able to
accurately calculate state-to-state information of all of the product channels. Besides our
theoretical developments, several cooperated work with the experiment will be briefly discussed.
chemistry field. To development new theories and improve the numerical efficiency for
calculating state-to-state quantum reactive scattering information using time-dependent quantum
wave packet method, plays an important role in molecular reaction dynamics field. In past
several years, we have developed several quantum reactive scattering theories, which are able to
accurately and efficiently calculate state-to-state reactive scattering differential cross sections, by
solving the long-standing so-called “coordinate problem”. For the first time, we would be able to
accurately calculate state-to-state information of all of the product channels. Besides our
theoretical developments, several cooperated work with the experiment will be briefly discussed.
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Presenters
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Zhigang Sun
Dalian Institute of Chemical Physics
Authors
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Zhigang Sun
Dalian Institute of Chemical Physics