Two-Dimensional WS2@Nitrogen-Doped Graphite for High-Performance Lithium Ion Batteries: Experiments and Molecular Dynamics Simulations

2018 ◽  
Vol 10 (44) ◽  
pp. 37928-37936 ◽  
Author(s):  
Tekalign Terfa Debela ◽  
Young Rok Lim ◽  
Hee Won Seo ◽  
Ik Seon Kwon ◽  
In Hye Kwak ◽  
...  
2021 ◽  
Author(s):  
Thejus R Kartha ◽  
Th Dhileep Reddy ◽  
Bhabani S. Mallik

We investigated the dynamics and transport of lithium-ion water-in-bisalt (WiBS) electrolytes that contain lithium bis(trifluorosulfonimide) (LiTFSI) and lithium triflate (LiOTf) at different concentrations and temperatures using classical molecular dynamics simulations....


Nanoscale ◽  
2019 ◽  
Vol 11 (22) ◽  
pp. 10984-10991 ◽  
Author(s):  
Jingjing Tang ◽  
Qifang Yin ◽  
Qian Wang ◽  
Qianqian Li ◽  
Hongtao Wang ◽  
...  

Porous silicon nanosheets are fabricated and exhibit good capacity and superb cyclability. Molecular dynamics simulation is performed to reveal the capacity-porosity correlation.


2017 ◽  
Vol 41 (21) ◽  
pp. 12901-12909 ◽  
Author(s):  
Chunfeng Shao ◽  
Ziqiang Wang ◽  
Errui Wang ◽  
Shujun Qiu ◽  
Hailiang Chu ◽  
...  

Guanine was, for the first time, used as a nitrogen source during the synthesis of nitrogen-doped porous carbons (NMCs) with enhanced electrochemical performance.


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