Mechanical Properties, Electronic Structures, and Potential Applications in Lithium Ion Batteries: A First-Principles Study toward SnSe2 Nanotubes

2014 ◽  
Vol 118 (48) ◽  
pp. 28291-28298 ◽  
Author(s):  
Chongyi Ling ◽  
Yucheng Huang ◽  
Hai Liu ◽  
Sufan Wang ◽  
Zhen Fang ◽  
...  
Keyword(s):  
Mechanical Properties ◽  
Lithium Ion Batteries ◽  
First Principles ◽  
Electronic Structures ◽  
Lithium Ion ◽  
First Principles Study ◽  
Potential Applications

First-principles study on h-BSi3 sheet as a promising high-performance anode for sodium-ion batteries

2021 ◽  
Author(s):  
Sankha Ghosh
Keyword(s):  
Lithium Ion Batteries ◽  
First Principles ◽  
High Performance ◽  
Lithium Ion ◽  
Sodium Ion ◽  
Earth’S Crust ◽  
Sodium Ion Batteries ◽  
First Principles Study ◽  
Earth's Crust

Seeking cheap, efficient and sustainable alternatives to lithium-ion batteries (LIBs), sodium-ion batteries (SIBs) has emerged as a realm of research, due to the abundance of Na in the earth's crust.

First principles study of P-doped borophene as anode materials for lithium ion batteries

2018 ◽  
Vol 427 ◽  
pp. 198-205 ◽  
Author(s):  
Hui Chen ◽  
Wei Zhang ◽  
Xian-Qiong Tang ◽  
Yan-Huai Ding ◽  
Jiu-Ren Yin ◽  
...  
Keyword(s):  
Lithium Ion Batteries ◽  
First Principles ◽  
Anode Materials ◽  
Lithium Ion ◽  
First Principles Study

First-principles study of monolayer SnS2(1−x)Se2x alloys as anode materials for lithium ion batteries

2018 ◽  
Vol 457 ◽  
pp. 256-263 ◽  
Author(s):  
Tianxing Wang ◽  
Lizhi Yin ◽  
Rumeng Zhao ◽  
Congxin Xia ◽  
Xu Zhao ◽  
...  
Keyword(s):  
Lithium Ion Batteries ◽  
First Principles ◽  
Anode Materials ◽  
Lithium Ion ◽  
First Principles Study

scholarly journals First-principles study on the effects of N and Al doping on the mechanical properties and electronic structures of TiC

RSC Advances ◽  
2020 ◽  
Vol 10 (60) ◽  
pp. 36295-36302
Author(s):  
Zhinan Cao ◽  
Na Jin ◽  
Jinwen Ye ◽  
Xu Du ◽  
Ying Liu
Keyword(s):  
Mechanical Properties ◽  
Electronic Structure ◽  
Plane Wave ◽  
First Principles ◽  
Electronic Structures ◽  
First Principles Calculations ◽  
Al Doping ◽  
First Principles Study

First-principles calculations are carried out by DFT within the CASTEP plane wave code to investigate the mechanical properties and electronic structure of N and Al doped TiC.

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