首页> 外文期刊>The journal of physical chemistry, A. Molecules, spectroscopy, kinetics, environment, & general theory >Product Rotational Polarization in Photo-initiated Bimolecular Reactions A + BC: Dependence on the Character of the Potential Energy Surface for Different Mass Combinations
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Product Rotational Polarization in Photo-initiated Bimolecular Reactions A + BC: Dependence on the Character of the Potential Energy Surface for Different Mass Combinations

机译:光引发的双分子反应A + BC中的产物旋转极化:取决于不同质量组合的势能面的特征

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摘要

In cases of light-heavy-light (LHL), light-light-heavy (LLH), and light-heavy-heavy (LHH) mass combinations, the product rotational polarization is reported using the quasiclassical trajectory method in the photoinitiated bimolecular reaction A + BC → AB + C on attractive, mixed, and repulsive surfaces. Four polarization-dependent differential cross sections (PDDCS) which are sensitive to many photoinitiated bimolecular reaction experiments are presented. Furthermore, the dihedral angle distribution P(φ_r) characterizing the K-K'-J' correlation and the distribution of angle between K and J' P(θ_r) are discussed. Finally, the angular distributions P(θ_rφ_r) of product rotational vectors in the form of polar plots in θ_r and φ_r are shown.
机译:在轻重(LHL),轻重(LLH)和轻重(LHH)质量组合的情况下,在光引发的双分子反应A中使用准经典轨迹方法报告了产物旋转极化+ BC→AB + C在有吸引力的,混合的和排斥的表面上。提出了对许多光引发的双分子反应实验敏感的四个偏振相关的微分截面(PDDCS)。此外,讨论了表征K-K'-J'相关性的二面角分布P(φ_r)以及K和J'P之间的角度分布P(θ_r)。最后,以θ_r和φ_r中的极坐标图的形式示出了乘积旋转矢量的角分布P(θ_rφ_r)。

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