An effective method to screen sodium-based layered materials for sodium ion batteries

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ID: 102304
2018
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Abstract
Sodium-ion batteries: searching for layered electrode materials Sodium-ion batteries are one step closer to market thanks to a computer program that screens for promising electrode materials. A team led by Zen Zhou at Nankai University in China developed a rapid, ‘high-throughput’ computational approach to search the vast online ‘Materials Project’ database for layered sodium-based materials. Once identified, the authors assessed the candidate materials’ potential for use in sodium-ion batteries by calculating their energy storage properties, such as volume change and sodium ion mobility, finding that a number of them-including Na(CuO)2, NaTiF4, Na2Zr(CuS2)2, Na3Co2SbO6, and Na2Cu(CO3)2–are potentially suitable for use as ‘insertion-type’ cathode materials. The authors hope their method could also be used to search for other types of layered compound for electrode materials, and accelerate the development of next-generation batteries.
Reference Key
zhang2018annpj Use this key to autocite in the manuscript while using SciMatic Manuscript Manager or Thesis Manager
Authors Zhang, Xu;Zhang, Zihe;Yao, Sai;Chen, An;Zhao, Xudong;Zhou, Zhen;
Journal npj computational materials
Year 2018
DOI
DOI not found
URL
http://link.springer.com/article/10.1038/s41524-018-0070-2
Keywords
Materials of engineering and construction. Mechanics of materials Technology (General) Science business petroleum refining. petroleum products management. industrial management fine arts computer software

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