Real time quantum propagation on a Monte Carlo trajectory guided grids of coupled coherent states: 26D simulation of pyrazine absorption spectrum
作者： Dmitrii V. Shalashilin , Mark S. Child
DOI: 10.1063/1.1776111
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摘要: In this work we apply the coupled coherent states technique of quantum molecular dynamics to simulation of the absorption spectrum of pyrazine. All 24 vibrational modes are taken into …
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