Preprint Article Version 1 Preserved in Portico This version is not peer-reviewed

Thermophysical and Transport Properties of Deep Eutectic Solvent Mixtures Containing Pure Choline Chloride/Ethylene Glycol with a Mole Ratio of 1:4 and Mixed with LiPF6 for Application in Redox-flow Batteries

Version 1 : Received: 16 November 2023 / Approved: 17 November 2023 / Online: 17 November 2023 (08:09:31 CET)

How to cite: Zargari Shastan, F.; Nowroozi, A. Thermophysical and Transport Properties of Deep Eutectic Solvent Mixtures Containing Pure Choline Chloride/Ethylene Glycol with a Mole Ratio of 1:4 and Mixed with LiPF6 for Application in Redox-flow Batteries. Preprints 2023, 2023111148. https://doi.org/10.20944/preprints202311.1148.v1 Zargari Shastan, F.; Nowroozi, A. Thermophysical and Transport Properties of Deep Eutectic Solvent Mixtures Containing Pure Choline Chloride/Ethylene Glycol with a Mole Ratio of 1:4 and Mixed with LiPF6 for Application in Redox-flow Batteries. Preprints 2023, 2023111148. https://doi.org/10.20944/preprints202311.1148.v1

Abstract

Redox-flow batteries are rechargeable batteries that store energy in two liquid electrolytes, separated by a membrane. During charging and discharging, the electrolytes flow through the membrane and undergo chemical reactions that generate or consume electrical energy. These batteries are known for their scalability and long cycle life and are versatile energy storage technologies developed to enhance efficiency and lower costs. Deep Eutectic Solvents (DES) are eco-friendly alternatives to traditional electrolytes, and their properties have been studied to improve the performance of redox-flow batteries. We investigated choline chloride/ethylene glycol (ChlCl/Eg) mixtures with LiPF6 salt at four concentrations through experimental and MD simulations. The thermophysical and transport properties of the mixture, including density, diffusion coefficient, viscosity, and ionic conductivity, were calculated across a temperature range of 298.15–398.5 K. Our findings indicate that an increase in salt concentration leads to a decrease in diffusion coefficients and ionic conductivity, while increasing the viscosity of the deep eutectic solvent. This research provides valuable insights into the behavior of DES mixtures and can aid in the design and optimization of DES-based processes for use in redox-flow batteries.

Keywords

DES; density; diffusion coefficient; viscosity; ionic conductivity; redox-flow batteries; molecular dynamics simulations

Subject

Chemistry and Materials Science, Applied Chemistry

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