Modelling metal complexation in solvent extraction systems
Access Status
Open access
Authors
Lunkov, Sergey
Date
2013Supervisor
Prof. Kate Wright
Prof. Julian Gale
Dr Keith Barnard
Type
Thesis
Award
PhD
Metadata
Show full item recordFaculty
Faculty of Science and Engineering, Department of Chemistry
Collection
Abstract
This thesis represents a theoretical investigation of synergistic solvent extraction of transition metal ions based on models for the commercial used components, namely LIX63 and Versatic10 acid. Quantum mechanical studies of oxime isomerisation have been conducted in order to understand the thermodynamic and kinetic properties of the syn/anti interconversion of LIX63, which is found to favour an oligomeric form in non-polar solvents.