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Oxygen Loss on Disordered Li-Excess, Mn-Rich Li-Ion Cathode Li(2)MnO(2)F through First-Principles Modeling

[Image: see text] Oxygen evolution energies were calculated for the {100}, {110}, {111}, and {112} type facets of the rock-salt-structured cation-disordered Li-excess, Mn-rich Li-ion (DRX) cathode Li(2)MnO(2)F at the fully lithiated, 25% delithiation, and 50% delithiation states. Our calculations sh...

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Detalles Bibliográficos
Autores principales: Burns, Jordan, Persson, Kristin A.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2023
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10653073/
https://www.ncbi.nlm.nih.gov/pubmed/38027546
http://dx.doi.org/10.1021/acs.chemmater.3c01815