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Updated: Sep 18, 2025

Rapid in-silico Battery Electrolyte Electrochemical Reaction Generation using 3T-VASP Multi-Scale Energy Minimization
Published on: August 22, 2025
High throughput screening of high entropy spinel electrolytes for multivalent batteries
Mahesh J Dheerasinghe1, Yi Gan2, Lin Wang1
1Department of Chemistry and Biochemistry, Florida State University, Tallahassee, FL, USA. bouyang@fsu.edu.
None:
High-entropy (HE) design emerged as a promising path for discovering multivalent superionic conductors. This work provides a computational exploration of the synthesizability of HE spinel-based electrolytes among the typical chemical space. Design principles have been established, while experimental synthesis has supported the stability rules predicted by computational data.
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