Adelaide M. Nolan

TL;DR: Garnet-type electrolyte has been considered one of the most promising and important solid-state electrolytes for batteries with potential benefits in energy density, electrochemical stability, high temperature stability, and safety, and this Review will survey recent development of garnet- type LLZO electrolytes.

TL;DR: This study used first principles computation to investigate the Li-ion diffusion, electrochemical stability, and interface stability of chloride and bromide materials and elucidated the origin of their high ionic conductivities and good electrochemical stabilities.

TL;DR: In this paper, the authors present an overview of recently developed computation techniques and their applications in understanding and advancing materials and interfaces in all-solid-state batteries, and highlight the computational studies in the design and discovery of new solid electrolyte materials and outline design guidelines for solid electrolytes and their interfaces.

TL;DR: The present work demonstrates a promising strategy to develop ceramic-compatible lithium metal-based anodes and hence low-impedance ASSBs and shows a dramatic modification in wettability with garnet SSE.

TL;DR: The authors combine unsupervised learning techniques and molecular dynamics simulations to discover new compounds with high Li-ion conductivity, demonstrating the capability of unsuper supervised learning for discovering materials over a wide materials space with limited property data.