Ion Association Constants for Lithium Ion Battery Electrolytes from First-Principles Quantum Chemistry
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DOI: 10.1149/2.1061914jes
Abstract: We provide a quantum chemical computational framework to calculate ion association constants relevant to lithium ion battery electrolytes. We compare our method to reported experimental values as the solvent, cation, and anion are varied. For… read more here.
Keywords: ion association; chemistry; ion; association constants ... See more keywords