2026-04-27T20:51:56Zhttps://riubu.ubu.es/oai/requestoai:riubu.ubu.es:10259/93202024-07-02T00:05:25Zcom_10259_4323com_10259_5086com_10259_2604col_10259_4330
Repositorio Institucional de la Universidad de Burgos
author
Gutiérrez Vega, Alberto
author
Rozas Azcona, Sara
author
Zamora Pastor, Lorena
author
Benito, Cristina
author
Atilhan, Mert
author
Aparicio Martínez, Santiago
2024-07-01T06:54:21Z
2024-07-01T06:54:21Z
2023-11-15
0888-5885
http://hdl.handle.net/10259/9320
10.1021/acs.iecr.3c02102
1520-5045
A deep eutectic solvent was formed by considering the mixtures of tetrabutylammonium chloride and levulinic acid, and it is studied via a combined theoretical and experimental approach. Physicochemical properties were measured as a function of temperature, providing a macroscopic characterization of the fluid. Quantum chemistry and classical molecular dynamics simulations were carried out for the nanoscopic characterization, providing attention to the nature, extension, and dynamics of the hydrogen bonding network, which is at the root of the properties of the fluid. The reported study allows multiscale characterization of this fluid as an archetypical example of a natural, low-cost, and sustainable fluid.
eng
Atribución 4.0 Internacional
Nature of a Tetrabutylammonium Chloride–Levulinic Acid Deep Eutectic Solvent
info:eu-repo/semantics/article
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URL
https://riubu.ubu.es/bitstream/10259/9320/1/Gutierrez-iecr_2023.pdf
File
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Gutierrez-iecr_2023.pdf