Surface Complexation Modelling
Elsevier, Sep 2, 2006 - Science - 652 pages
Surface Complexation Modelling deals with various aspects associate to the modelling of solutes adsorption from of solutes from aqueous solutions to minerals. The individual contributions cover fundamental aspects and applications. Applications cover case studies and present consistent surface complexation parameter sets. The model approaches range from simplistic to mechanistic. More fundamental contributions address underlying phenomena or stress the opportunities of modern computational methods. Several mineral systems are covered, including goethite, gibbsite, clay minerals etc.
Surface Complexation Modelling presents the state-of-the-art of surface complexation modelling and suggests ideas for further model development. A number of chapters are authored by scientists working on nuclear waste storage, where the retention of radionuclides contributes to preventing radionuclide migration from the repository to the biosphere. Other contributions come from soil and environmental chemists with an interest in reactive transport of pollutants in soils or aquifers.
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2006 Elsevier Ltd acid acid-base Acta activity coefficients adsorption amorphous silica anions aqueous atoms calculated capacitance cation sorption cations charge density Chem chemical Colloid Interface Sci concentration correlation Cosmochim curves data sets deprotonation diffuse layer dissolution rate double layer Dzombak electrolyte electron electrostatic equation equilibrium constants experimental data FITEQL function Geochim gibbsite goethite goethite preparations hematite Hiemstra HNCA hydration hydrogen bond hydrolysis hydrolysis constants hydrous ferric oxide hydroxyl interaction ionic strength kJ mol LFER ligands Lutzenkirchen editor measurements mineral modelling teams molecular montmorillonite obtained oxygen parameters particles pH Fig Phys plane Poisson-Boltzmann equation predicted proton quartz range reactivity rutile silanol silica simulations solid solubility solution solvation sorbing sorption data sorption edges sorption model speciation spectroscopic surface charge surface complexation constants surface complexation model surface groups surface reactions surface sites surface species Table temperature thermodynamic titration values W.H. Van Riemsdijk water molecules zeta potential
Page ii - INTERFACE SCIENCE AND TECHNOLOGY Series Editor: ARTHUR HUBBARD In this series: Vol. 1: Clay Surfaces: Fundamentals and Applications Edited by F. Wypych and KG Satyanarayana Vol. 2: Electrokinetics in Microfluidics By Dongqing Li Vol. 3: Radiotracer Studies of Interfaces Edited by G. Horanyi Vol. 4: Emulsions: Structure Stability and Interactions Edited by DN Petsev Vol. 5: Inhaled Particles By Chiu-sen Wang Vol.