Solvation Structure of LiClO4/Ethylene Carbonate Solution near a Graphite Electrode in Lithium-ion Batteries: 3D-RISM Study
Author:
Affiliation:
1. Department of Molecular Engineering, Kyoto University, Nishikyo-ku, Kyoto 615-8510, Japan
2. Elements Strategy Initiative for Catalysts and Batteries (ESICB), Kyoto University, Nishikyo-ku, Kyoto 615-8520, Japan
Publisher
The Chemical Society of Japan
Subject
General Chemistry
Link
http://www.journal.csj.jp/doi/pdf/10.1246/cl.171127
Reference18 articles.
1. Lithium-Ion Batteries: Solid-Electrolyte Interphase, ed. by P. B. Balbuena, Y. Wang, World Scientific,2004.
2. Electrolytes and Interphases in Li-Ion Batteries and Beyond
3. On Electrolyte-Dependent Formation of Solid Electrolyte Interphase Film in Lithium-Ion Batteries: Strong Sensitivity to Small Structural Difference of Electrolyte Molecules
4. Near-Shore Aggregation Mechanism of Electrolyte Decomposition Products to Explain Solid Electrolyte Interphase Formation
5. M. P. Allen, D. J. Tildesley,Computer Simulation of Liquids, Oxford University Press,1989.
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1. Free Energy and Solvation Structure Analysis for Adsorption of Aromatic Molecules at Pt(111)/Water Interface by 3D-RISM Theory;Chemistry Letters;2022-07-05
2. Low-Cost Computing of the Thermophysical Properties of Organic–Inorganic Halide Perovskites by Density Functional Theory Combined with the Three-Dimensional Reference Interaction Site Method;The Journal of Physical Chemistry C;2021-03-16
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4. Thermodynamic Study of LiClO4 Activity Coefficients in Aqueous Solution at (288.15, 298.15, and 308.18) K;Journal of Chemical & Engineering Data;2018-10-15
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