@misc{indiciae5b913d8e78b4, title = {Modeling Electron Injection at Semiconductor–Molecule Interfaces using First-Principles Dynamics Simulation: Effects of Nonadiabatic Coupling, Self-energy, and Surface Models}, author = {Li, Lesheng and Kanai, Yosuke}, year = {2019}, doi = {10.1021/acs.jpcc.9b01820}, url = {https://www.osti.gov/biblio/1566534}, note = {Source identifier: 1566534} }