4.7 Article

Effect of the mixture composition of BmimBF4/PC on the solvation structure of C153 in as seen from molecular dynamics study

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Summary: This article investigates the solvation in IL/MS mixtures using steady-state and time-resolved measurements of coumarin 153 in BmimBF(4)/propylene carbonate. The experimental results showed a lengthening of solvation times with increasing IL molar fraction, with IL dominating the slow portion of the solvation response. MD simulations provided a deep understanding and excellent agreement with experimental data, shedding light on the molecular rearrangements in different IL/MS mixture regimes.

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