Simulating the ionic liquid mixing with organic-solvent clarifies the mixture’s SFG spectral behavior and the specific surface region originating SFG
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DOI: 10.1038/s41598-024-74561-8
Abstract: Molecular dynamics (MD) simulation of the green ionic liquid [C₄mim][PF₆] mixed with polar benzonitrile (BNZ) solvent provides detailed insights into their structural and dynamic properties, essential for electrochemistry and materials science applications. The simulations we… read more here.
Keywords: solvent; surface; simulating ionic; sfg ... See more keywords