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Chapter
Atomistic Simulations of Battery Materials and Processes
This chapter presents a comprehensive overview of our computational work on battery materials, covering the latest developments in atomistic modeling of electrolytes, electrodes, and electrode/electrolyte inte...
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Article
Open AccessRole of solvent-anion charge transfer in oxidative degradation of battery electrolytes
Electrochemical stability windows of electrolytes largely determine the limitations of operating regimes of lithium-ion batteries, but the degradation mechanisms are difficult to characterize and poorly unders...
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Article
Lithium Dendrite Inhibition on Post-Charge Anode Surface: The Kinetics Role
We report experiments and molecular dynamics calculations on the kinetics of electrodeposited lithium dendrites relaxation as a function of temperature and time. We found that the experimental average length o...
