Study of interactions of various ionic species with solvents toward the design of receptors |
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| Authors: | N Jiten Singh Adriana C Olleta Anupriya Kumar Mina Park Hai-Bo Yi Indrajit Bandyopadhyay Han Myoung Lee P Tarakeshwar Kwang S Kim |
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| Institution: | (1) National Creative Research Center for Superfunctional Materials, Department of Chemistry, Division of Molecular and Life Sciences, Pohang University of Science and Technology, San-31, Hyojadong, Namgu, Pohang, 790-784, Korea |
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| Abstract: | In earlier studies, the interactions of isolated ionic species with various solvents were investigated using ab initio calculations.
The ionic species investigated included cations (proton, hydronium, ammonium, and metal cations) and anions (single electron,
hydroxide, and halide anions). However in the present study, we investigate the interactions of these ionic species with the
solvent in the presence of other competing ionic species. We also elaborate on how the information obtained from these extensive
studies have been employed in designing and synthesizing various kinds of novel ionophores and receptors. |
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