Hydration of Li+-ion in atom-bond electronegativity equalization method–7P water: A molecular dynamics simulation study

2005 ◽  
Vol 122 (8) ◽  
pp. 084514 ◽  
Author(s):  
Xin Li ◽  
Zhong-Zhi Yang
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Simulation Study ◽  
Dynamics Simulation ◽  
Electronegativity Equalization ◽  
Electronegativity Equalization Method ◽  
Li Ion ◽  
Atom Bond ◽  
Equalization Method

Temperature and Concentration Effects on Li+-Ion Hydration. A Molecular Dynamics Simulation Study

2003 ◽  
Vol 107 (14) ◽  
pp. 3234-3242 ◽  
Author(s):  
A. V. Egorov ◽  
A. V. Komolkin ◽  
V. I. Chizhik ◽  
P. V. Yushmanov ◽  
A. P. Lyubartsev ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Simulation Study ◽  
Dynamics Simulation ◽  
Concentration Effects ◽  
Ion Hydration ◽  
Li Ion ◽  
Temperature And Concentration Effects

Electrode/Electrolyte Interface in Sulfolane-Based Electrolytes for Li Ion Batteries: A Molecular Dynamics Simulation Study

2012 ◽  
Vol 116 (45) ◽  
pp. 23871-23881 ◽  
Author(s):  
Lidan Xing ◽  
Jenel Vatamanu ◽  
Oleg Borodin ◽  
Grant D. Smith ◽  
Dmitry Bedrov
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Simulation Study ◽  
Dynamics Simulation ◽  
Li Ion Batteries ◽  
Electrolyte Interface ◽  
Li Ion
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