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Analysis of a Li-Ion Nanobattery with Graphite Anode Using Molecular Dynamics Simulations

Victor Ponce, Diego E. Galvez-Aranda and Jorge M. Seminario
The Journal of Physical Chemistry C 121 (23) 12959 (2017)
https://doi.org/10.1021/acs.jpcc.7b04190

Density functional theory calculations andab initiomolecular dynamics simulations for diffusion of Li+within liquid ethylene carbonate

Mahesh Datt Bhatt, Maenghyo Cho and Kyeongjae Cho
Modelling and Simulation in Materials Science and Engineering 20 (6) 065004 (2012)
https://doi.org/10.1088/0965-0393/20/6/065004

Thermodynamic and kinetic properties of the Li-graphite system from first-principles calculations

Kristin Persson, Yoyo Hinuma, Ying Shirley Meng, Anton Van der Ven and Gerbrand Ceder
Physical Review B 82 (12) (2010)
https://doi.org/10.1103/PhysRevB.82.125416

Threefold Increase in the Young’s Modulus of Graphite Negative Electrode during Lithium Intercalation

Yue Qi, Haibo Guo, Louis G. Hector and Adam Timmons
Journal of The Electrochemical Society 157 (5) A558 (2010)
https://doi.org/10.1149/1.3327913

In Situ Observation of Strains during Lithiation of a Graphite Electrode

Yue Qi and Stephen J. Harris
Journal of The Electrochemical Society 157 (6) A741 (2010)
https://doi.org/10.1149/1.3377130

Molecular Dynamics Study of Graphite/Electrolyte Interfaces

Andrés Márquez and Perla B. Balbuena
Journal of The Electrochemical Society 148 (6) A624 (2001)
https://doi.org/10.1149/1.1372216