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- W3014837269 abstract "Potential electrolytes for lithium ion batteries (LIB) depicting high electrochemical stability and ionic conductivity still represents a great challenge. Herein, we investigate the reduction stability and Li + cation interactions with substituted cyclic phospholanium (CylP 5 + ) and pyrrolidinium (Pyr + ) ionic liquids (ILs) with bis(trifluoromethanesulfonyl)imide (TFSI − ) anion. The cations CylP 5 + and Pyr + are functionalized with varying chain lengths of alkyl and alkoxy substituents and their reduction potentials evaluated with respect to Li + /Li. CylP 5 + cations, in general have better stability than Pyr + based ILs, while the alkoxy substitution is found to lower the reduction stability compared to alkyl substituents in both ILs. Furthermore, the interaction energies between the substituent modified-cations (C), Li + cation and the anion (A) were evaluated. The ion-pair (C-A) interaction energies on addition of Li + cation is shown to decrease for both Pyr + and CylP 5 + cations with shorter alkoxy chain lengths, thereby implying faster diffusion of ions due to weaker interactions. Similarly, among the two cations, lowest ΔE were noted between alkoxy substituted [Li(CylP 5 )] 2+ cation and TFSI − , signifying faster diffusion of ions in CylP 5 + based electrolytes than that of Pyr + based ILs. These results govern the synthesis of novel ILs with promising base cation and functionalization for LIB." @default.
- W3014837269 created "2020-04-10" @default.
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- W3014837269 date "2020-01-05" @default.
- W3014837269 modified "2023-10-01" @default.
- W3014837269 title "Evaluation of Electrochemical Stability and Li-ion Interactions in Ether Functionalized Pyrrolidinium and Phospholanium Ionic Liquids" @default.
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- W3014837269 doi "https://doi.org/10.1149/1945-7111/ab8061" @default.
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