Quantum dynamics of solid Ne upon photo-excitation of a NO impurity: a Gaussian wave packet approach.


A high-dimensional quantum wave packet approach based on Gaussian wave packets in Cartesian coordinates is presented. In this method, the high-dimensional wave packet is expressed as a product of time-dependent complex Gaussian functions, which describe the motion of individual atoms. It is applied to the ultrafast geometrical rearrangement dynamics of NO… (More)


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