Applied Chemistry and Chemical Engineering, Volume 1

This new book brings together innovative research, new concepts, and novel developments in the application of informatics tools for applied chemistry and computer science. It presents a modern approach to modeling and calculation and also looks at experimental design in applied chemistry and chemical engineering. The volume discusses the developments of advanced chemical products and respective tools to characterize and predict the chemical material properties and behavior. Providing numerous comparisons of different methods with one another and with different experiments, not only does this book summarize the classical theories, but it also exhibits their engineering applications in response to the current key issues. Recent trends in several areas of chemistry and chemical engineering science, which have important application to practice, are discussed. Applied Chemistry and Chemical Engineering: Volume 1: Mathematical and Analytical Techniques provides valuable information for chemical engineers and researchers as well as for graduate students. It demonstrates the progress and promise for developing chemical materials that seem capable of moving this field from laboratory-scale prototypes to actual industrial applications. Volume 2 will focus principles and methodologies in applied chemistry and chemical engineering.

A. K. Haghi, PhD, holds a BSc in urban and environmental engineering from the University of North Carolina (USA), an MSc in mechanical engineering from North Carolina A&T State University (USA), a DEA in applied mechanics, acoustics and materials from the Université de Technologie de Compiègne (France), and a PhD in engineering sciences from Université de Franche-Comté (France). He is the author and editor of 165 books, as well as 1000 published papers in various journals and conference proceedings. Dr. Haghi has received several grants, consulted for a number of major corporations, and is a frequent speaker to national and international audiences. Since 1983, he served as professor at several universities. He is currently Editor-in-Chief of the International Journal of Chemoinformatics and Chemical Engineering and Polymers Research Journal and on the editorial boards of many International journals. He is also a member of the Canadian Research and Development Center of Sciences and Cultures (CRDCSC), Montreal, Quebec, Canada. Devrim Balköse, PhD, is currently a faculty member in the Chemical Engineering Department at Izmir Institute of Technology, Izmir, Turkey. She graduated from the Middle East Technical University in Ankara, Turkey, with a degree in chemical engineering. She received her MS and PhD degrees from Ege University, Izmir, Turkey, in 1974 and 1977 respectively. She became Associate Professor in macromolecular chemistry in 1983 and Professor in process and reactor engineering in 1990. She worked as research assistant, assistant professor, associate professor, and professor between 1970-2000 at Ege University. She was the Head of Chemical Engineering Department at Izmir Institute of Technology, Izmir, Turkey, between 2000 and 2009. Her research interests are in polymer reaction engineering, polymer foams and films, adsorbent development, and moisture sorption. Her research projects are on nanosized zinc borate production, ZnO polymer composites, zinc borate lubricants, antistatic additives, and metal soaps. Omari Vasilii Mukbaniani, DSc, is Professor and Director of the Macromolecular Chemistry Department of I. Javakhishvili Tbilisi State University, Tbilisi, Georgia. He is also the Director of the Institute of Macromolecular Chemistry of Academy of Sciences of the Georgian Republic. For several years he was a member of advisory board of the Journal Proceedings of Iv. Javakhishvili Tbilisi State University (Chemical Series) and contributing editor of the journal Polymer News and the Polymers Research Journal. His research interests include polymer chemistry, polymeric materials and chemistry of organosilicon compounds. Andrew G. Mercader, PhD, studied Physical Chemistry at the Faculty of Chemistry of La Plata National University (UNLP), Buenos Aires, Argentina, from 1995-2001. Afterwards he joined Shell Argentina to work as Luboil, Asphalts and Distillation Process Technologist, as well as Safeguarding and Project Technologist. His PhD work on the development and applications of QSAR/QSPR theory was performed at the Theoretical and Applied Research Institute located at La Plata National University (INIFTA). He received a post-doctoral scholarship to work on theoretical-experimental studies of biflavonoids at IBIMOL (ex PRALIB), Faculty of Pharmacy and Biochemistry, University of Buenos Aires (UBA). He is currently a member of the Scientific Researcher Career in the Argentina National Research Council, at INIFTA.

Digraphs, Graphs and Thermodynamic Equations. Usefulness and Limits of Predictive Relationships. Computational Model for By-Product of Wastewater Treatment. Complex Calculation of a Critical Path of Motion of a Corpuscle Taking into Account a Regime and Design of the Apparatus. The Modern Approach to Modelling and Calculation of Efficiency of Process of a Gas Cleaning. Numerical Modelling and Visualization of Traffic of Dispersion Particles in the Apparatus. Computing the Augmented Eccentric Connectivity Indices of Nanostar Dendrimer D3[N]. Hydraulic Model Calibration Process. Quantum-Chemical Calculations of the Molecules 1- Methylbicycleo[4,1,0] Heptane 2,4-Spiroheptane by PM3 Method. District Meter Area (DMA) of Water Distribution System. Metal Control on Structure and Function of Ni(Fe) Dioxygenases Included in methionine Salvage Oathway. Role of Tyr-fragment and Macrostructures in Mechanism of Catalysis on Model Systems. The Silica-Polymer Composites of the System of HEMA-TEOS: The Synthesis, Thermo Mechanical Properties and the Features of the Kinetic of the Process. Photo Responsive Materials Containing Azomoieties: A Facile Approach in Molecular Imprinting. Green Nanotechnology: An Approach towards Environment Safety. A Note on Preparation of Nanofilter from carbon Nanotubes. Control of Fluidic Jet Repulsion in Electro Spinning Process. Modification of Urea-Formaldehyde Resin with Collagen Biopolymers. A Research Note on Polymerization of 2-Hydroxyethyl Methacrylate Initiated with Vanadyl Ionic Complex.