Quantifying the Stability of the Hydronium Ion in Organic Solvents With Molecular Dynamics Simulations.

Front Chem · 2019 · PMC6594219 · PMID 31275924

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a clear trendno p-value reported

We further computed the RDF between the hydronium ion and pure solvents ( Supplementary Figure 7 , Supplementary Material) to determine if solvent structure correlated with the transfer free energies, but we do not find a clear trend to explain the results found in Figure 5C .

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