Open AccessModeling Electron Injection at Semiconductor–Molecule Interfaces using First-Principles Dynamics Simulation: Effects of Nonadiabatic Coupling, Self-energy, and Surface Models
Author(s) -
Lesheng Li,
Yosuke Kanai
Publication year - 2019
Publication title -
the journal of physical chemistry c
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.401
H-Index - 289
eISSN - 1932-7455
pISSN - 1932-7447
DOI - 10.1021/acs.jpcc.9b01820
Subject(s) - semiconductor , excited state , electron transfer , electron , coupling (piping) , molecule , chemical physics , materials science , molecular dynamics , physics , chemistry , atomic physics , quantum mechanics , optoelectronics , metallurgy
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