Lithium Ionic Conductivity and Stability Of Cubic Li7La3Zr2O12 Solid Electrolyte A First-Principles Study

Garnet structured cubic LLZO crystal (Li56La24Zr16O96) is one of the most promising solid electrolytes for next-generation solid-state lithium-ion batteries. Ab initio molecular dynamics simulations have been employed to study the impacts of lithium vacancy defect and doping concentration on the lit...

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Bibliographic Details
Main Author: Saha, Sudipto
Format: Others
Published: North Dakota State University 2021
Subjects:
Online Access:https://hdl.handle.net/10365/32052