Thermodynamic modeling of aqueous and mixed solvent electrolyte systems

Benjamin Caudle, Toni E. Kirkes, Cheng Hsiu Yu, Chau Chyun Chen

Research output: Chapter in Book/Report/Conference proceedingChapterpeer-review

Abstract

Electrolyte systems are ubiquitous and play critical roles in a wide variety of industrial and natural processes, including basic chemical manufacturing, pharmaceutical processing, nuclear waste processing, etc. This chapter describes key thermodynamic relationships for electrolyte systems and advances in electrolyte thermodynamic models, as well as three examples of how to apply these models to aqueous and mixed solvent electrolytes. Various thermodynamic properties of electrolyte systems, such as vapor pressure, osmotic coefficient, mean ionic activity coefficient, solution enthalpy, heat capacity, and salt solubility, are integral to process simulation of natural and industrial processes. These properties are all derived from the activity coefficients of chemical species in the system, and, therefore, accurate calculation of activity coefficients as functions of temperature and solution composition has become the focus of electrolyte thermodynamic models. The chapter summarizes the Pitzer and the electrolyte nonrandom two-liquid model.

Original languageEnglish
Title of host publicationChemical Engineering in the Pharmaceutical Industry
PublisherWiley
Pages493-504
Number of pages12
ISBN (Electronic)9781119600800
ISBN (Print)9781119285496
DOIs
StatePublished - Apr 13 2019

Keywords

  • Aqueous electrolyte solution
  • Electrolyte nonrandom two-liquid model
  • Electrolyte systems
  • Electrolyte thermodynamic models
  • Mixed solvent electrolytes
  • Pitzer model
  • Thermodynamic relationships

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