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Royal Society of Chemistry, Chemical Science, 2024

DOI: 10.1039/d3sc06107h

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Replica exchange molecular dynamics for Li-intercalation in graphite: a new solution for an old problem

Journal article published in 2024 by Heesoo Park ORCID, David S. Wragg ORCID, Alexey Y. Koposov ORCID
This paper is made freely available by the publisher.
This paper is made freely available by the publisher.

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Abstract

Li intercalation and graphite stacking have been extensively studied because of the importance of graphite in commercial Li-ion batteries.