A stochastic framework based on complex absorbing potentials is introduced to simulate exciton transport in molecular aggregates, applied to cyanine dyes to study defect and topology effects with a new packing-based classification scheme.
Complex absorbing potential based Lorentzian fitting scheme and time dependent quantum transport.The Journal of Chemi- 22 cal Physics2014,141
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Simulating Exciton Transport with Complex Absorbing Potentials
A stochastic framework based on complex absorbing potentials is introduced to simulate exciton transport in molecular aggregates, applied to cyanine dyes to study defect and topology effects with a new packing-based classification scheme.