Journal
CHEMICAL PHYSICS
Volume 548, Issue -, Pages -Publisher
ELSEVIER
DOI: 10.1016/j.chemphys.2021.111224
Keywords
Photoinduced electron transfer; Vibronic effects; Non-condon effects; Exactly solvable model; Quantum mechanics
Funding
- National Science Foundation [CHE1412033]
- National Institute of Health [GM118332]
- National Natural Science Foundation of China
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This study provides the first exact solution to the time-independent Schrodinger equation of a model Hamiltonian for photo-induced electronic transfer reactions, offering a new direction for understanding vibronic effects in electron transfer dynamics.
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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