Exact Eigenenergies Of A Model Of Vibronically Coupled Electron Transfer Reactions

CHEMICAL PHYSICS(2021)

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摘要
We present the first exact solution to the time-independent Schrodinger equation of a model Hamiltonian consisting of a vibrational mode coupled to three electronic states. This Hamiltonian serves as a generic model for photo-induced electronic transfer reactions. The solution is non-perturbative and can be applied to ET reactions with weak and strong electronic and vibrational coupling strengths. This work suggests a new direction towards understanding the vibronic effects in ET dynamics beyond the non-adiabatic limit and Condon approximation.
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关键词
Photoinduced electron transfer, Vibronic effects, Non-condon effects, Exactly solvable model, Quantum mechanics
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