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    • Keywords


      CS& #8322; ; electrostatic model; site polarizability model; ionic liquid solutions.

    • Abstract


      The environment of a solute molecule in an ionic liquid is likely to have large fluctuating electrostatic fields, and so the electrostatic properties of such a solute including its charge distribution and its polarizability may make a difference to both its static and dynamic properties. We have developed a new model forthe static electrostatic distribution in the CS₂ molecule with 7 charged sites and anisotropic polarizability on the carbon site and isotropic polarizability on the sulfurs. We have investigated static and dynamic properties of the neat liquid and solutions of CS₂ in an ionic liquid, [dmim][NTf₂].

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    • Dates

  • Journal of Chemical Sciences | News

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      Posted on July 25, 2019

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