Interfaces and interphases in all-solid-state batteries with inorganic solid electrolytes
All-solid-state batteries (ASSBs) have attracted enormous attention as one of the critical
future technologies for safe and high energy batteries. With the emergence of several highly …
future technologies for safe and high energy batteries. With the emergence of several highly …
Atomic‐scale design of anode materials for alkali metal (Li/Na/K)‐ion batteries: Progress and perspectives
The development and optimization of high‐performance anode materials for alkali metal ion
batteries is crucial for the green energy evolution. Atomic scale computational modeling …
batteries is crucial for the green energy evolution. Atomic scale computational modeling …
Computational screening of cathode coatings for solid-state batteries
Solid-state batteries are on the roadmap for commercialization as the next generation of
batteries because of their potential for improved safety, power density, and energy density …
batteries because of their potential for improved safety, power density, and energy density …
Bond valence pathway analyzer—an automatic rapid screening tool for fast ion conductors within softBV
LL Wong, KC Phuah, R Dai, H Chen… - Chemistry of …, 2021 - ACS Publications
Solid-state fast ionic conductors are of great interest due to their application potential
enabling the development of safer high-performance energy and conversion systems …
enabling the development of safer high-performance energy and conversion systems …
High-throughput screening platform for solid electrolytes combining hierarchical ion-transport prediction algorithms
B He, S Chi, A Ye, P Mi, L Zhang, B Pu, Z Zou, Y Ran… - Scientific Data, 2020 - nature.com
The combination of a materials database with high-throughput ion-transport calculations is
an effective approach to screen for promising solid electrolytes. However, automating the …
an effective approach to screen for promising solid electrolytes. However, automating the …
Modeling the solid electrolyte interphase: Machine learning as a game changer?
The solid electrolyte interphase (SEI) is a complex passivation layer that forms in situ on
many battery electrodes such as lithium‐intercalated graphite or lithium metal anodes. Its …
many battery electrodes such as lithium‐intercalated graphite or lithium metal anodes. Its …
Lithium ion conduction in cathode coating materials from on-the-fly machine learning
The performance of solid-state lithium ion batteries can be improved through the use of
interfacial coating materials, but computationally identifying materials with sufficiently high …
interfacial coating materials, but computationally identifying materials with sufficiently high …
Evidence for a Solid-Electrolyte Inductive Effect in the Superionic Conductor Li10Ge1–xSnxP2S12
SP Culver, AG Squires, N Minafra… - Journal of the …, 2020 - ACS Publications
Strategies to enhance ionic conductivities in solid electrolytes typically focus on the effects of
modifying their crystal structures or of tuning mobile-ion stoichiometries. A less-explored …
modifying their crystal structures or of tuning mobile-ion stoichiometries. A less-explored …
A database of ionic transport characteristics for over 29 000 inorganic compounds
L Zhang, B He, Q Zhao, Z Zou, S Chi… - Advanced Functional …, 2020 - Wiley Online Library
Transport characteristics of ionic conductors play a key role in the performance of
electrochemical devices such as solid‐state batteries, solid‐oxide fuel cells, and sensors …
electrochemical devices such as solid‐state batteries, solid‐oxide fuel cells, and sensors …
Towards autonomous high-throughput multiscale modelling of battery interfaces
To date, battery research largely follows an “Edisonian” approach based on experimental
trial-and-error in contrast to a systematic strategy of design-of-experiments. Battery …
trial-and-error in contrast to a systematic strategy of design-of-experiments. Battery …