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First-principles investigation on crystal, electronic structures and Diffusion barriers of NaNi1/3Co1/3Mn1/3O2 for advanced rechargeable Na-ion batteries

Article ID Journal Published Year Pages File Type
7959955 Computational Materials Science 2015 7 Pages PDF
Abstract
Energy profiles for Na diffusion in NaNi1/3Co1/3Mn1/3O2 and pristine NaCoO2.131
Keywords
first principles calculationSodium ion batterieselectronic structureCathode materialDiffusion barriers
Related Topics
Physical Sciences and Engineering Engineering Computational Mechanics
Preview
First-principles investigation on crystal, electronic structures and Diffusion barriers of NaNi1/3Co1/3Mn1/3O2 for advanced rechargeable Na-ion batteries
Authors
Jingcang Su, Yong Pei, Zhenhua Yang, Xianyou Wang,
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Journal
Computational Materials Science
Journal: Computational Materials Science
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first principles calculation
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Diffusion barriers
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