Litcius/Paper detail

New Electrical Conductivity Model for Electrolyte Solutions Based on the Debye–Hückel–Onsager Theory

Saman Naseri Boroujeni, Bjørn Maribo‐Mogensen, Xiaodong Liang, Georgios M. Kontogeorgis

2023The Journal of Physical Chemistry B22 citationsDOI

Abstract

A new electrical conductivity model is developed for unassociated electrolyte solutions based on the Debye-Hückel-Onsager theory. In this model, we assume that a single cation and a single anion with their crystallographic ionic radii are in a continuum medium of the solvent(s). We compare the predictions of the developed model with the experimental measurements of binary 1:1, 2:1, 1:2, 2:2, 1:3, 3:1, 2:3, 3:2, 3:3, 1:4, and 2:4 aqueous solutions in the temperature range 273.15-373.15 K. Our results are in good agreement with the experimental data. An extension of the model was formulated to incorporate ion pairing, and its effectiveness was evaluated across three essential systems: 2:2 aqueous sulfate solutions, ionic liquid-co-solvent systems, and NaCl-water-1,4-dioxane solutions. This adaptation demonstrated a strong correlation with experimental data, highlighting the broad applicability.

Topics & Concepts

Debye–Hückel equationElectrolyteThermodynamicsAqueous solutionChemistryIonic bondingSolventIonStrong electrolyteConductivityElectrical resistivity and conductivityChemical physicsPhysical chemistryPhysicsOrganic chemistryQuantum mechanicsElectrodeChemical and Physical Properties in Aqueous SolutionsThermodynamic properties of mixturesSpectroscopy and Quantum Chemical Studies