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Preparation and probing of Ar-Cl radical complexes from UV photodissociation of the Ar-HCl cluster

机译:Ar-HCl团簇的紫外光解离制备Ar-Cl自由基络合物

摘要

Photodissociation of Ar-HCl is simulated by exact wavepacket calculations. The asymptotic wavepacket is projected out onto the product states corresponding to several excitation energies of Ar-HCl. A high relative efficiency of Ar-Cl formation is found at low and high cluster excitation energies. The ro-vibrational state distribution of the Ar-Cl radical formed is reflected in the kinetic-energy distribution of the H fragment. Photolysis of Ar-HCl then appears as an efficient method for preparing Ar-Cl radicals, simultaneously probing their final state distribution.
机译:Ar-HCl的光解离通过精确的波包计算进行模拟。渐近波包被投影到与Ar-HCl的几种激发能相对应的乘积态上。在较低和较高的团簇激发能下,Ar-Cl形成的相对效率很高。 H片段的动能分布反映了所形成的Ar-Cl自由基的旋转振动态分布。然后,将Ar-HCl的光解作为制备Ar-Cl自由基的有效方法,同时探测其最终状态分布。

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