Reaction dynamics on bifurcating potential energy surfaces
作者： Wayne A. Kraus , Andrew E. DePristo
DOI: 10.1007/BF00527706
关键词:
摘要: Classical trajectories were run on a local fit to the bifurcating transition region of Valtazanos and Ruedenberg ab initio potential energy surface for cyclopropylidene allene reaction, also several variations this surface. The trajectory results analyzed determine outcome as function initial conditions, plots these are presented.
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