First-principles study of NaxTiO2 with trigonal bipyramid structures: an insight into sodium-ion battery anode applications

Author:

Choe Song-Hyok12345,Yu Chol-Jun12345ORCID,Ri Kum-Chol12345,Kim Jing-Song12345,Jong Un-Gi12345ORCID,Kye Yun-Hyok12345,Hong Song-Nam12345

Affiliation:

1. Chair of Computational Materials Design

2. Faculty of Materials Science

3. Kim Il Sung University

4. Taesong District

5. Democratic People's Republic of Korea

Abstract

Crystalline structures, energetics, electrode voltage, and electronic structures of NaxTiO2 with trigonal bipyramid structures were obtained with first-principles calculations.

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Reference53 articles.

1. European Commission Climate Action , Annual Conference of Parties (COP) at COP21 at Stade de France (Gate E) in Paris , 2015

2. The path towards sustainable energy

3. Electrical Energy Storage for the Grid: A Battery of Choices

4. Is lithium the new gold?

5. Challenges for Rechargeable Li Batteries

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