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Experimental Reconstructions of Kohn-Sham and Dyson Orbitals using High-Resolution Molecular Electro

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报告题目   Experimental Reconstructions of Kohn-Sham and Dyson Orbitals using High-Resolution Molecular Electro
报告人   Michael S. Deleuze
报告人单位   Research Group of Theoretical Chemistry and Molecular Modelling,Hasselt University, Belgium
报告时间   2011-09-22
报告地点   合肥微尺度物质科学国家实验室9004会议室
主办单位   合肥微尺度物质科学国家实验室
报告介绍
Electron Momentum Spectroscopy (EMS) is a powerful “orbital imaging” technique, which enables direct experimental reconstructions of one-electron transition momentum densities associated to specific ionization channels. In this talk, we will illustrate for a number of cases treated by our group over the last 10 years how a proper analysis of EMS experiments gives insight in momentum space onto the consequences of electron correlation (configuration interactions) and nuclear dynamics in the initial (neutral) and final (ionized) state onto the shape (spread and topology) of molecular orbitals.

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