Deep eutectic solvents: A review of fundamentals and applications

BB Hansen, S Spittle, B Chen, D Poe, Y Zhang… - Chemical …, 2020 - ACS Publications
Deep eutectic solvents (DESs) are an emerging class of mixtures characterized by
significant depressions in melting points compared to those of the neat constituent …

Computer simulations of deep eutectic solvents: Challenges, solutions, and perspectives

D Tolmachev, N Lukasheva, R Ramazanov… - International journal of …, 2022 - mdpi.com
Deep eutectic solvents (DESs) are one of the most rapidly evolving types of solvents,
appearing in a broad range of applications, such as nanotechnology, electrochemistry …

Eutectic electrolytes in advanced metal-ion batteries

L Geng, X Wang, K Han, P Hu, L Zhou, Y Zhao… - ACS Energy …, 2021 - ACS Publications
Metal-ion batteries (MIBs) are promising for large-scale energy storage because they can
alleviate the inherent intermittency of renewable energy. As an indispensable part of MIBs …

Modeling the physicochemical properties of natural deep eutectic solvents

A Kovács, EC Neyts, I Cornet, M Wijnants… - …, 2020 - Wiley Online Library
Natural deep eutectic solvents (NADES) are mixtures of naturally derived compounds with a
significantly decreased melting point owing to specific interactions among the constituents …

Perspectives and guidelines on thermodynamic modelling of deep eutectic solvents

III Alkhatib, D Bahamon, F Llovell… - Journal of Molecular …, 2020 - Elsevier
In the quest for green and sustainable solvents, deep eutectic solvents (DESs) have
emerged as an attractive and multipurpose material with demonstrated applicability in …

Quantum chemical insight into the interactions and thermodynamics present in choline chloride based deep eutectic solvents

DV Wagle, CA Deakyne, GA Baker - The Journal of Physical …, 2016 - ACS Publications
We report quantum chemical calculations performed on three popular deep eutectic solvents
(DESs) in order to elucidate the molecular interactions, charge transfer interactions, and …

Nanoscale spatial heterogeneity in deep eutectic solvents

S Kaur, A Gupta, HK Kashyap - The Journal of Physical Chemistry …, 2016 - ACS Publications
In this article, we report a molecular dynamics simulation study on the X-ray and neutron
scattering structures of deep eutectic solvents (DESs) and show that the DESs studied …

Charge spreading in deep eutectic solvents

S Zahn, B Kirchner, D Mollenhauer - ChemPhysChem, 2016 - Wiley Online Library
Ab initio molecular dynamic simulations reveal significantly reduced ion charges in several
choline‐based deep eutectic solvents, which are cheap and eco‐friendly alternatives to …

Effect of natural deep eutectic solvents of non-eutectic compositions on enzyme stability

A Kovács, M Yusupov, I Cornet, P Billen… - Journal of Molecular …, 2022 - Elsevier
Natural deep eutectic solvents (NADES) represent a green alternative to common organic
solvents in the biochemical industry due to their benign behavior and tailorable properties …

Antiplasticization of polymer materials: Structural aspects and effects on mechanical and diffusion-controlled properties

L Mascia, Y Kouparitsas, D Nocita, X Bao - Polymers, 2020 - mdpi.com
Antiplasticization of glassy polymers, arising from the addition of small amounts of
plasticizer, was examined to highlight the developments that have taken place over the last …