Electrical and Lithium Ion Dynamics in Three Main Components of Solid Electrolyte Interphase from Density Functional Theory Study

2011 ◽  
Vol 115 (14) ◽  
pp. 7044-7049 ◽  
Author(s):  
Y. C. Chen ◽  
C. Y. Ouyang ◽  
L. J. Song ◽  
Z. L. Sun
Keyword(s):  
Density Functional Theory ◽  
Solid Electrolyte ◽  
Density Functional ◽  
Solid Electrolyte Interphase ◽  
Lithium Ion ◽  
Ion Dynamics ◽  
Density Functional Theory Study ◽  
Functional Theory ◽  
Main Components

A density functional theory study on the thermodynamic and dynamic properties of anthraquinone analogue cathode materials for rechargeable lithium ion batteries

2017 ◽  
Vol 19 (19) ◽  
pp. 12480-12489 ◽  
Author(s):  
Shu-Jing Yang ◽  
Xiao-Ya Qin ◽  
Rongxing He ◽  
Wei Shen ◽  
Ming Li ◽  
...  
Keyword(s):  
Density Functional Theory ◽  
Lithium Ion Batteries ◽  
Density Functional ◽  
Lithium Battery ◽  
Dynamic Properties ◽  
Lithium Ion ◽  
Density Functional Theory Study ◽  
Functional Theory ◽  
Rechargeable Lithium Battery ◽  
Theoretical Design

Thermodynamic and dynamic properties of anthraquinone as the cathode material of rechargeable lithium battery can be largely improved using theoretical design.

Structural, Electrical, and Lithium Ion Dynamics of Li 2 MnO 3 from Density Functional Theory

2015 ◽  
Vol 32 (1) ◽  
pp. 017102 ◽  
Author(s):  
Yong-Chang Chen ◽  
Miao Huo ◽  
Yang Liu ◽  
Tong Chen ◽  
Cheng-Cai Leng ◽  
...  
Keyword(s):  
Density Functional Theory ◽  
Density Functional ◽  
Lithium Ion ◽  
Ion Dynamics ◽  
Functional Theory
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