Polaron-assisted nonadiabatic dynamics in protonated TiO2 with surface water molecule

We investigated the polaron-assisted nonadiabatic dynamics in protonated TiO2, as well as the polaron-H2O coupling and its effects on the relaxation of photogenerated electrons. We observed that different polaron hopping regimes result in varied nonadiabatic couplings and relaxations of excited elec...

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Bibliographic Details
Main Authors: Zhongfei Xu, Chuanjia Tong, Rutong Si, Gilberto Teobaldi, Limin Liu
Format: Article
Language:English
Published: KeAi Communications Co., Ltd. 2023-10-01
Series:ChemPhysMater
Subjects:
Online Access:http://www.sciencedirect.com/science/article/pii/S2772571523000189