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Deep Eutectic Solvents in Liquid-Liquid Extraction : Correlation and Molecular Dynamics Simulation - Papu Kumar Naik

Deep Eutectic Solvents in Liquid-Liquid Extraction

Correlation and Molecular Dynamics Simulation

By: Papu Kumar Naik, Nikhil Kumar, Nabendu Paul

Hardcover | 7 November 2022 | Edition Number 1

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Deep Eutectic Solvents (DES) are new class of green solvents that opens a whole new world of opportunities for separation challenges. This book comprehensively provides a detailed discussion of their application as an extractive solvent in separation processes, adopting Molecular Dynamics (MD) simulations for atomistic insight into the solute transfer across bi-phasic systems. Further, it explains ternary and quaternary mixtures, including molecular dynamics simulation of relevant DES systems.

Features:

  • Covers application of Deep Eutectic Solvents (DES) in extraction of aromatics and polyaromatics from fuel oil by Liquid-Liquid extraction.
  • Studies eutectic behavior with respect to hydrocarbon and aqueous solutions.
  • Describes molecular dynamics insights of extraction by DES.
  • Explores possible industrial applicability of potential DES.
  • Includes results from Gaussian, NAMD and PACKMOL software package.

This book aims at Researchers and Graduate students in Fuels and Petrochemicals, Separation Science, Chromatography, Chemical Processing and Design.

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