Structural stability and stabilization of Li2MoO3-Reference-Cited by-同舟云学术

Structural stability and stabilization of Li2MoO3

Published:2017 Issue:27 Volume:19 Page:17538-17543
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Tian Meng¹²³⁴⁵,Gao Yurui⁶⁷⁸⁹,Xiao Ruijuan¹²³⁴⁵,Wang Zhaoxiang¹²³⁴⁵^ORCID,Chen Liquan¹²³⁴⁵

Affiliation:

1. Key Laboratory for Renewable Energy

2. Beijing Key Laboratory for New Energy Materials and Devices

3. National Laboratory for Condensed Matter Physics

4. Institute of Physics

5. Chinese Academy of Sciences

6. Department of Physics and Astronomy

7. California State University Northridge

8. Northridge

9. USA

Abstract

First-principles calculations indicate that the distortion of the MoO₆ octahedra drives the Mo migration upon delithiation from Li₂MoO₃. Sb doping can stabilize its structure and promote its Li diffusion.

Funder

National Natural Science Foundation of China

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2017/CP/C7CP03594B

Reference40 articles.

1. Design and Properties Prediction of AMCO3F by First-Principles Calculations

2. Structural Understanding of Superior Battery Properties of Partially Ni-Doped Li2MnO3 as Cathode Material

3. Advances in manganese-oxide ‘composite’ electrodes for lithium-ion batteries

4. Electrochemical performances of 0.9Li2MnO3–0.1Li(Mn0.375Ni0.375Co0.25)O2 cathodes: Role of the cycling induced layered to spinel phase transformation

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