At a time when U.S. high school students are producing low scores in mathematics and science on international examinations, a thorough grounding in physical chemistry should not be considered optional for science undergraduates. Based on the author's thirty years of teaching, Essentials of Physical Chemistry merges coverage of calculus with chemistry and molecular physics in a friendly yet thorough manner. Reflecting the latest ACS guidelines, the book can be used as a one or two semester course, and includes special topics suitable for senior projects. The book begins with a math and physics review to ensure all students start on the same level, and then discusses the basics of thermodynamics and kinetics with mathematics tuned to a level that stretches students' abilities. It then provides material for an optional second semester course that shows students how to apply their enhanced mathematical skills in a brief historical development of the quantum mechanics of molecules. Emphasizing spectroscopy, the text is built on a foundation of quantum chemistry and more mathematical detail and examples. It contains sample classroom-tested exams to gauge how well students know how to use relevant formulas and to display successful understanding of key concepts. Coupling the development of mathematical skills with chemistry concepts encourages students to learn mathematical derivations Mini-biographies of famous scientists make the presentation more interesting from a "people" point of view Stating the basic concepts of quantum chemistry in terms of analogies provides a pedagogically useful technique Covering key topics such as the critical point of a van der Waals gas, the Michaelis-Menten equation, and the entropy of mixing, this classroom-tested text highlights applications across the range of chemistry, forensic science, pre-medical science and chemical engineering. In a presentation of fundamental topics held together by clearly established mathematical models, the book supplies a quantitative discussion of the merged science of physical chemistry.

A description of catalytic systems commonly used as model systems in the laboratory and as industrial catalysts in large-scale operations, and a discussion of the mechanisms operating in these reactions. Attempts to describe the elementary steps by quantum chemical methods are also shown, as are rec

A comprehensive treatment of a large family of polymers useful in a wide range of applications in such fields as automotive, pharmaceutical, cosmetic, metal-working, mining, industrial coating, textile, construction, and home furnishings. Summarizes the chemistry and mechanisms; provides basic prepa

This successful textbook undergoes a change of character in the third edition. Where earlier editions covered organic polymer chemistry, the third edition covers both physical and organic chemistry. Thus kinetics and thermodynamics of polymerization reactions are discussed.

This edition is also distinct from all other polymer textbooks because of its coverage of such currently hot topics as photonic polymers, electricity conducting polymers, polymeric materials for immobilization of reagents and drug release, organic solar cells, organic light emitting diodes.

This textbook contains review questions at the end of every chapter, references for further reading, and numerous examples of commercially important processes."

This book examines both the potential application of electronic nose technology, and the current state of development of chemical sensors for the detection of vapours from explosives, such as those used in landmines. The two fields have developed, somewhat in parallel, over the past decade and so one of the purposes of this workshop, on which the book is based, was to bring together scientists from the two fields in order to challenge the two communities and, mutually, stimulate both fields.

It begins with a review of the basic principles of an electronic nose and explores possible ways in which the detection limit of conventional electronic nose technology can be reduced to the level required for the trace levels observed for many explosive materials. Next are reviews of the use of several different types of solid-state chemical sensors: polymer-based sensors, i.e. chemiluminescent, fluorescent and optical, to detect explosive materials; metal oxide semiconducting resistive sensors; and then electrochemical sensors. Next, different pattern recognition techniques are presented to enhance the performance of chemical sensors. Then biological systems are considered as a possible blue-print for chemical sensing. The biology can be employed either to understand the way insects locate odorant sources, or to understand the signal processing neural pathways. Next is a discussion of some of the new types of electronic noses; namely, a fast GC column with a SAW detector and a micromechanical sensor. Finally, the important issues of sampling technologies and the design of the microfluidic systems are considered. In particular, the use of pre-concentrators and solid phase micro extractors to boost the vapour concentration before it is introduced to the chemical sensor or electronic nose.

Modern adhesive dentistry has numerous applications in cariology, as well as in aesthetic and pediatric dentistry, prosthodontics, implantology, and orthodontics-in essence, in comprehensive dental care. This unique book addresses various ramifications of adhesion and adhesives in the broad domain of dentistry. The topics covered include testing aspects of dental materials, dentin bonding, restorations, and adhesion promotion. This book reflects the cumulative wisdom of many world-renowned researchers and provides a useful reference to anyone involved in the various aspects of dentistry.

Pathways to Modern Physical Chemistry: An Engineering Approach with Multidisciplinary Applications focuses on recent trends and takes a systematic and practical look at theoretical aspects of materials chemistry. The book describes the characterization and analysis methods for materials and explains physical transport mechanisms in various materials. Not only does this book summarize the classical theories of materials chemistry, but it also exhibits their engineering applications in response to the current key issues. Recent trends in several areas are explored, including polymer science, textile engineering, and chemical engineering science, which have important application to practice.

Cell adhesion comes into play in almost all domains of life. The range of situations in which it occurs, involving organisms, living tissues, microorganisms or single cells, is endless. Cell adhesion is involved in the binding of a cell to a surface, extracellular matrix, or another cell using cell adhesion molecules. It is crucial in the formation and maintenance of coherent multicellular structures. Cell surface adhesion molecules (integrins, for example) which transmit information from the extracellular matrix to the cell play vital roles in numerous cellular processes. Some of these include: cell growth, differentiation, embryogenesis, immune cell transmigration and response, and cancer metastasis. Also cell adhesion is involved in most of pathological situations. This book is divided into four parts as follows: Part 1: Fundamentals of Cell Adhesion; Part 2: Methods to Study Cell Adhesion; Part 3: Surface Treatments to Control Cell Adhesion and Behavior; and Part 4: Cell Adhesion in Medicine and Therapy. A bountiful information is covered in this book which represents the cumulative wisdom of many world-renowned researchers( physicists, materials scientists, chemists and biologists) engaged in unraveling the mechanisms of cell adhesion and how to mitigate or control it. It quite patent from the topics covered in this book that the subject of cell adhesion is truly interdisciplinary. This book should be of great interest and value to anyone interested in cell adhesion which is vitally important to human life.

This book provides an introduction on applications of lasers in Chemistry. It describes laser as a tool for chemistry, the consideration involved in describing a laser beam and what happens to beam as it is propagated through a gas. The book is useful for graduates and advanced undergraduates.

This book is designed to provide authoritative reviews in the field of modern electroanalytical chemistry defined in its broadest sense. It is helpful to practicing analytical chemists interested in learning about and applying electroanalytical techniques.

This volume provides authoritative reviews in the field of modern electroanalytical chemistry defined in its broadest sense. It is valuable to practicing analytical chemists interested in learning about and applying electroanalytical techniques.

Providing a carefully developed and comprehensive overview of the corrosion chemistry of metallic materials, this book covers the principal methods of corrosion prevention. It includes a systematic study of the physical chemistry of the surface supported by state-of-the-art analysis methods. The author builds a scientific foundation by developing thermodynamics and kinetics of electrode-electrolyte interaction and other surface processes. This allows him to analyze and derive the models that are used in the study of corrosion for metals and their alloys, including electrochemical attack, high-temperature oxidation, passivity, atmospheric corrosion, as well as the roles of wear and strain.

This book provides an introduction to colloid science, based on the application of the principles of physical chemistry. Early chapters assume only an elementary knowledge of physical chemistry and provide the basis for more thorough discussion in later chapters covering specific aspects of colloid science. The widespread occurrence of colloids is stressed and the more important industrial applications of colloid technology are outlined. The final chapter deals with the future of colloid science and indicates the directions in which further developments are likely to take place. The book is ideal for undergraduate courses and, supplemented by further reading, for postgraduates too. It will also be useful to industrial research workers who wish to become familiar with the basic ideas and their many important applications to industry.

Reagents in Mineral Technology provides comprehensive coverage of both basic as well asapplied aspects of reagents utilized in the minerals industry.This outstanding, single-source reference opens with an explicit account of flotation fundamentals,including coverage of wetting phenomena, mineral/water interfacial phenomena, flo tationchemistry, and flocculation and dispersion of mineral suspensions.It then discusses flotation of sulfide and nonsulfide minerals, with attention to formation ofclithiolates, formation of metal thiol compounds, application of fatty acids, sulfosuccinic acids,amines, and other collectors.Reagents in Mineral Technology also reviews adsorption of surfactants on minerals .. .details adsorption of polymers .. . and considers the chemistry and application of chelation agentsin minerals separations.Additional chapters consider grinding aids, frothers, inorganic and polymeric depressants,dewatering and filtering aids, analytical techniques, and much more.Unique in its depth of coverage, Reagents in Mineral Technology will prove an invaluablereference for mineral engineers and processors; analytical, surface, colloid, and physical chemists;petroleum, petrochemical, metallurgical, and mining engineers; and for use in advancedundergraduate- and graduate-level courses in these and related fields.

This book is based on the proceedings of the conference "The role of surfactants in new and emerging technology". It examines the position of surfactants in the new growth areas, and describes the needs for surfactant research to facilitate advances in those areas.

Unique in focus, Surface Chemistry and Geochemistry of Hydraulic Fracturing examines the surface chemistry and phenomena in the hydrofracking process. Under great scrutiny as of late, the physico-chemical properties of hydrofracking are fully detailed and explained. Topics include the adsorption-desorption of gas on the shale reservoir surface and relevant waste-water treatment dependent on various surface chemistry principles. The aim of this book is to help engineers and research scientists recognize the basic surface chemistry principles related to this subject. Written by a long-time expert in the field, this book presents an unbiased account of the hard science and engineering involved in a resource that is gaining growing attention within the community.

This book discusses the basic principles and processes of solar energy conversion in natural photosynthesis. It then directly compares them with recent developments and concepts currently being pursued in artificial photosynthetic systems that are capable of utilizing sunlight to convert carbon dioxide and water into a chemical fuel. In this regard, the main focus is on photoelectrochemical cells, in which semiconducting photoanodes and -cathodes modified with (electro-) catalysts are used to oxidize water, produce hydrogen and reduce carbon dioxide in a monolithic device. The fundamental photochemical and photophysical processes involved are presented and discussed, along with protection mechanisms and efficiency calculations for both natural and artificial photosynthesis. In turn, key parameters that are crucial for the efficient operation of natural photosynthesis are identified. Lastly, their validity and applicability in the design of artificial solar-driven water-splitting systems are examined.

The main objective of the book is to highlight the modeling of magnetic particles with different shapes and magnetic properties, to provide graduate students and young researchers information on the theoretical aspects and actual techniques for the treatment of magnetic particles in particle-based simulations. In simulation, we focus on the Monte Carlo, molecular dynamics, Brownian dynamics, lattice Boltzmann and stochastic rotation dynamics (multi-particle collision dynamics) methods. The latter two simulation methods can simulate both the particle motion and the ambient flow field simultaneously. In general, specialized knowledge can only be obtained in an effective manner under the supervision of an expert. The present book is written to play such a role for readers who wish to develop the skill of modeling magnetic particles and develop a computer simulation program using their own ability. This book is therefore a self-learning book for graduate students and young researchers. Armed with this knowledge, readers are expected to be able to sufficiently enhance their skill for tackling any challenging problems they may encounter in future.

Ultrafast Dynamics at the Nanoscale provides a combined experimental and theoretical insight into the molecular-level investigation of light-induced quantum processes in biological systems and nanostructured (bio)assemblies. Topics include DNA photostability and repair, photoactive proteins, biological and artificial light-harvesting systems, plasmonic nanostructures, and organic photovoltaic materials, whose common denominator is the key importance of ultrafast quantum effects at the border between the molecular scale and the nanoscale. The functionality and control of these systems have been under intense investigation in recent years in view of developing a detailed understanding of ultrafast nanoscale energy and charge transfer, as well as fostering novel technologies based on sustainable energy resources. Both experiment and theory have made big strides toward meeting the challenge of these truly complex systems. This book, thus, introduces the reader to cutting-edge developments in ultrafast nonlinear optical spectroscopies and the quantum dynamical simulation of the observed dynamics, including direct simulations of two-dimensional optical experiments. Taken together, these techniques attempt to elucidate whether the quantum coherent nature of ultrafast events enhances the efficiency of the relevant processes and where the quantum-classical boundary sets in, in these high-dimensional biological and material systems. The chapters contain well-illustrated accounts of the authors' research work, including didactic introductory material, and address a multidisciplinary audience from chemistry, physics, biology, and materials sciences. The book is, therefore, a must-have for graduate- and postgraduate-level researchers who wish to learn about molecular nanoscience from a combined spectroscopic and theoretical viewpoint.

This volume provides an overview of the theory and practical aspects of the detersive process, detergency testing, analysis of detergents, and progress in formulating detergents. It discusses temperature effects and cold water cleaning only from the kinetic and mechanistic points of view.

This important new book provides innovative material, including peer-reviewed chapters and survey articles on new applied research and development, in the scientifically important field of QSAR in medicinal chemistry. QSAR is a growing field because available computing power is continuously increasing, QSAR's potential is enormous, limited only by the quantity and quality of the available experimental input, which are also continuously improving. The number of possible structures for the design of new organic compounds is difficult to imagine, and QSAR helps to predict their activities even before synthesis. The book provides a wealth of valuable information and: * Presents an overview of recent developments in QSAR methodologies along with a brief history of QSAR * Covers the available web resource tools and in silico techniques used in virtual screening and drug discovery processes, compiling an extensive review of web resources in the following categories: databases related to chemical compounds, drug targets, and ADME/toxicity prediction; molecular modeling and drug designing; virtual screening; pharmacophore generation; molecular descriptor calculation software; software for quantum mechanics; ligand binding affinities (docking); and software related to ADME/toxicity prediction * Reviews the rm2 as a more stringent measure for the assessment of model predictivity compared to traditional validation metrics, being specifically important since validation is a crucial step in any QSAR study * Presents linear model improvement techniques that take into account the conformation flexibility of the modeled molecules * Summarizes the building processes of four different pharmacophore models: common-feature, 3D-QSAR, protein-, and protein-ligand complexes * Shows the role of different conceptual density functional theory based chemical reactivity descriptors, such as hardness, electrophilicity, net electrophilicity, and philicity in the design of different QSAR/QSPR/QSTR models * Reviews the use of chemometrics in PPAR research highlighting its substantial contribution in identifying essential structural characteristics and understanding the mechanism of action * Presents the structures and QSARs of antimicrobial and immunosuppressive cyclopeptides, discussing the balance of antimicrobial and haemolytic activities for designing new antimicrobial cyclic peptides * Shows the relationship between DFT global descriptors and experimental toxicity of a selected group of polychlorinated biphenyls, exploring the efficacy of three DFT descriptors * Reviews the applications of Quantitative Structure-Relative Sweetness Relationships (QSRSR), showing that the last decade was marked by an increase in the number of studies regarding QSAR applications for both understanding the sweetness mechanism and synthesizing novel sweetener compounds for the food additive industry The wide coverage makes this book an excellent reference for those in chemistry, pharmacology, and medicine as well as for research centers, governmental organizations, pharmaceutical companies, and health and environmental control organizations.

This book presents up-to-date information about the catalysis and surface properties of liquid metals and liquid alloys. It is intended for use by chemical engineers and researchers in catalysis, surface science, liquid metals, and chemical process technologies.

As the title suggests, this monograph features the physicochemical behavior and supramolecular organization of polymers. The book consists of four chapters dealing with solution properties, viscoelastic behavior, physicochemical aspects at interfaces and supramolecular structures of polymeric systems. The classical treatment of the physicochemical behavior of polymers is presented in such a way that the book will meet the requirements of a beginner in the study of polymeric systems in solution and in some aspects of the solid state, as well as those of the experienced researcher in other types of materials. Physicochemical behavior and Supramolecular Organization of Polymers is ultimately, a contribution to the chemistry of materials; it is a powerful reference tool for students and scientists working both in polymer chemistry, polymer physics and materials science.

The dielectric properties especially of glassy materials are nowadays explored at widely varying temperatures and pressures without any gap in the spectral range from Hz up to the Infrared, thus covering typically 20 decades or more. This extraordinary span enables to trace the scaling and the mutual interactions of relaxation processes in detail, e.g. the dynamic glass transition and secondary relaxations, but as well far infrared vibrations, like the Boson peak. Additionally the evolution of intra-molecular interactions in the course of the dynamic glass transition is also well explored by (Fourier Transform) Infrared Spectroscopy. This volume within 'Advances in Dielectrics' summarizes this knowledge and discusses it with respect to the existing and often competing theoretical concepts.

This book describes potentiometric methods for determining stability constants and explains how these constants can be used to describe metal ion speciation in complex environmental and biological systems. It also provides three original computer programs on a disk for calculating stability constants and for using stability constants to calculate concentrations of molecular species in solution.
The author gives examples of calculations for simple metal chelates, for metal complexes of large organic molecules, and for mixtures containing several metal ions and complexing agents in aqueous solution. They also describe common errors in calculating stability constants and how to avoid them.
This carefully revised second edition is now even more useful to the reader, and, in particular, to those who make use of the program disk. Each program has been revised to improve speed, control, and error trapping.