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Microemulsion as model to predict free energy of transfer of electrolyte in solvent extraction

Authors :
Jean-François Dufrêche
Thomas Zemb
Simon Gourdin-Bertin
Magali Duvail
Modélisation Mésoscopique et Chimie Théorique (LMCT)
Institut de Chimie Séparative de Marcoule (ICSM - UMR 5257)
Centre National de la Recherche Scientifique (CNRS)-Institut de Chimie du CNRS (INC)-Université de Montpellier (UM)-Ecole Nationale Supérieure de Chimie de Montpellier (ENSCM)-Commissariat à l'énergie atomique et aux énergies alternatives (CEA)-Centre National de la Recherche Scientifique (CNRS)-Institut de Chimie du CNRS (INC)-Université de Montpellier (UM)-Ecole Nationale Supérieure de Chimie de Montpellier (ENSCM)-Commissariat à l'énergie atomique et aux énergies alternatives (CEA)
Tri ionique par les Systèmes Moléculaires auto-assemblés (LTSM)
ANR-18-CE29-0010,MULTISEPAR,Modelisation multi-échelle des phases organiques pour l'extraction liquid-liquide(2018)
European Project: 320915,EC:FP7:ERC,ERC-2012-ADG_20120216,REE-CYCLE(2013)
Commissariat à l'énergie atomique et aux énergies alternatives (CEA)-Institut de Chimie du CNRS (INC)-Centre National de la Recherche Scientifique (CNRS)-Université de Montpellier (UM)-Ecole Nationale Supérieure de Chimie de Montpellier (ENSCM)
Université de Montpellier (UM)-Commissariat à l'énergie atomique et aux énergies alternatives (CEA)-Institut de Chimie du CNRS (INC)-Centre National de la Recherche Scientifique (CNRS)-Université de Montpellier (UM)-Ecole Nationale Supérieure de Chimie de Montpellier (ENSCM)
Université de Montpellier (UM)
Source :
Solvent Extraction and Ion Exchange, Solvent Extraction and Ion Exchange, Taylor & Francis, 2022, 40 (1-2), pp.28-63. ⟨10.1080/07366299.2021.1953259⟩, Solvent Extraction and Ion Exchange, 2022, 40 (1-2), pp.28-63. ⟨10.1080/07366299.2021.1953259⟩
Publication Year :
2022
Publisher :
HAL CCSD, 2022.

Abstract

Special Issue on Hierarchical Organization in Solvent Extraction; International audience; We consider here the extraction of metals in the form of salts transferred from an aqueous to a solvent phase. Extraction is triggered by complexation and quenched by the associated necessary reorganization of the structured solvent phase. The extraction of ions changes the relative fraction of extractant molecules that is not part of the highly curved surfactant monolayer and is dispersed molecularly in the oil, and also the polar volume fraction including co-extracted water. The free energy and corresponding microstructures of the water-poor microemulsions are modelled in the frame of the Gaussian random fields (GRF) model. The curvature frustration energy significantly contributes to the free energy of extraction. A typical example of predicted isotherm using the GRF model is compared to the classically considered supramolecular complex formation, together with a minimal Langmuir model and an explicit monomer-to-film equilibrium of amphiphilic extractant. The corresponding small-angle scattering spectra and morphology changes are shown. One implication is that selectivity between a hydrated and a non-hydrated species is concentration dependent and cannot be considered as a constant as a function of the extractant concentration.

Details

Language :
English
ISSN :
07366299 and 15322262
Database :
OpenAIRE
Journal :
Solvent Extraction and Ion Exchange, Solvent Extraction and Ion Exchange, Taylor & Francis, 2022, 40 (1-2), pp.28-63. ⟨10.1080/07366299.2021.1953259⟩, Solvent Extraction and Ion Exchange, 2022, 40 (1-2), pp.28-63. ⟨10.1080/07366299.2021.1953259⟩
Accession number :
edsair.doi.dedup.....ca93e4342332973b5fea0377ad4bcb14
Full Text :
https://doi.org/10.1080/07366299.2021.1953259⟩