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Modeling electrochemical properties of LiMn[Formula: see text] Co[Formula: see text] BO[Formula: see text] for cathode materials in lithium-ion rechargeable batteries

In this work, we report first-principle calculations of the electrochemical properties of lithitated and delithiated LiMn[Formula: see text] Co[Formula: see text] BO[Formula: see text] ([Formula: see text] , 0.25, 0.5, 0.75, 1) crystals based on the density functional theory (DFT) with the generaliz...

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Detalles Bibliográficos
Autores principales: Nhapulo, Sérgio Leonardo, de Almeida, Jailton Souza
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8178305/
https://www.ncbi.nlm.nih.gov/pubmed/34088918
http://dx.doi.org/10.1038/s41598-021-90317-0