Defect, Diffusion and Dopant Properties of NaNiO<sub>2</sub>: Atomistic Simulation Study

Defect, Diffusion and Dopant Properties of NaNiO<sub>2</sub>: Atomistic Simulation Study

Sodium nickelate, NaNiO<sub>2</sub>, is a candidate cathode material for sodium ion batteries due to its high volumetric and gravimetric energy density. The use of atomistic simulation techniques allows the examination of the defect energetics, Na-ion diffusion and dopant properties with...

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Bibliographic Details
Main Authors: Ruwani Kaushalya, Poobalasuntharam Iyngaran, Navaratnarajah Kuganathan, Alexander Chroneos
Format: Article
Language:English
Published: MDPI AG 2019-08-01
Series:Energies
Subjects:
 NaNiO<sub>2</sub>
defects
Na diffusion
dopants
atomistic simulation
Online Access:https://www.mdpi.com/1996-1073/12/16/3094

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https://www.mdpi.com/1996-1073/12/16/3094

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