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Imaging the square of the correlated two-electron wave function of a hydrogen molecule

机译:成像氢分子的相关双电子波函数的平方

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摘要

The toolbox for imaging molecules is well-equipped today. Some techniques visualize the geometrical structure, others the electron density or electron orbitals. Molecules are many-body systems for which the correlation between the constituents is decisive and the spatial and the momentum distribution of one electron depends on those of the other electrons and the nuclei. Such correlations have escaped direct observation by imaging techniques so far. Here, we implement an imaging scheme which visualizes correlations between electrons by coincident detection of the reaction fragments after high energy photofragmentation. With this technique, we examine the H2 two-electron wave function in which electron–electron correlation beyond the mean-field level is prominent. We visualize the dependence of the wave function on the internuclear distance. High energy photoelectrons are shown to be a powerful tool for molecular imaging. Our study paves the way for future time resolved correlation imaging at FELs and laser based X-ray sources.
机译:如今,用于分子成像的工具箱设备齐全。一些技术可视化几何结构,其他技术可视化电子密度或电子轨道。分子是多体系统,其组成之间的相关性是决定性的,一个电子的空间和动量分布取决于其他电子和原子核的空间和动量分布。迄今为止,这样的相关性已经逃脱了成像技术的直接观察。在这里,我们实现了一种成像方案,通过高能光碎裂后同时检测反应片段来可视化电子之间的相关性。通过这项技术,我们研究了H2两电子波函数,其中超出平均场能级的电子与电子之间的相关性非常突出。我们可视化了波函数对核间距离的依赖性。高能光电子被证明是分子成像的强大工具。我们的研究为将来在FEL和基于激光的X射线源进行时间分辨相关成像铺平了道路。

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