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首页> 外文期刊>The Journal of Chemical Physics >Quantum and classical study of surface characterization by three-dimensional helium atom scattering
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Quantum and classical study of surface characterization by three-dimensional helium atom scattering

机译:三维氦原子散射表征表面的量子和经典研究

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摘要

Exact time-dependent wavepacket calculations of helium atom scattering from model symmetric, chiral, and hexagonal surfaces are presented and compared with their classical counterparts. Analysis of the momentum distribution of the scattered wavepacket provides a convenient method to obtain the resulting energy and angle resolved scattering distributions. The classical distributions are characterized by standard rainbow scattering from corrugated surfaces. It is shown that the classical results are closely related to their quantum counterparts and capture the qualitative features appearing therein. Both the quantum and classical distributions are capable of distinguishing between the structures of the three surfaces.
机译:提出了精确的与时间有关的波包计算方法,用于计算从模型对称,手性和六边形表面散射的氦原子,并将其与经典模型进行比较。对散射波包的动量分布进行分析提供了一种方便的方法来获得所得的能量和角度分辨的散射分布。经典分布的特征是从波纹表面散射出标准的彩虹。结果表明,经典结果与它们的量子对应关系密切,并捕获了其中出现的定性特征。量子分布和经典分布都能够区分三个表面的结构。

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