With contributions from experts from both academia and industry, this book provides up-to-date reviews and promising approaches for corrosion control of metals and alloys via sustainable biopolymers and carbon nanomaterials coatings, focusing on the wonder material "graphene" which is more solid than steel. This book delivers essential information for improving the environmental and economic viability of current coating technologies. It is also a valuable reference for those who are interested in corrosion science and corrosion protection including professionals from the industry as well as academia.

Covers important supramolecules. Contains compilation of the different threads of supramolecular chemistry. Covers important supramolecules. Covers important environmental and biological applications. Covers important techniques at relevant places.

Winner of the PROSE Award for Chemistry & Physics 2010

Acknowledging the very best in professional and scholarly publishing, the annual PROSE Awards recognise publishers' and authors' commitment to pioneering works of research and for contributing to the conception, production, and design of landmark works in their fields. Judged by peer publishers, librarians, and medical professionals, Wiley are pleased to congratulate Professor Ian Fleming, winner of the PROSE Award in Chemistry and Physics for "Molecular Orbitals and Organic Chemical Reactions."

Molecular orbital theory is used by chemists to describe the arrangement of electrons in chemical structures. It is also a theory capable of giving some insight into the forces involved in the making and breaking of chemical bonds--the chemical reactions that are often the focus of an organic chemist's interest. Organic chemists with a serious interest in understanding and explaining their work usually express their ideas in molecular orbital terms, so much so that it is now an essential component of every organic chemist's skills to have some acquaintance with molecular orbital theory.

"Molecular Orbitals and Organic Chemical Reactions" is both a simplified account of molecular orbital theory and a review of its applications in organic chemistry; it provides a basic introduction to the subject and a wealth of illustrative examples. In this book molecular orbital theory is presented in a much simplified, and entirely non-mathematical language, accessible to every organic chemist, whether student or research worker, whether mathematically competent or not. Topics covered include:

- Molecular Orbital Theory

- Molecular Orbitals and the Structures of Organic Molecules

- Chemical Reactions -- How Far and How Fast

- Ionic Reactions -- Reactivity

- Ionic Reactions -- Stereochemistry

- Pericyclic Reactions

- Radical Reactions

- Photochemical Reactions

"Molecular Orbitals and Organic Chemical Reactions: Student Edition" is an invaluable first textbook on this important subject for students of organic, physical organic and computational chemistry.

The Reference Edition edition takes the content and the same non-mathematical approach of the Student Edition, and adds extensive extra subject coverage, detail and over 1500 references. The additional material adds a deeper understanding of the models used, and includes a broader range of applications and case studies. Providing a complete in-depth reference for a more advanced audience, this edition will find a place on the bookshelves of researchers and advanced students of organic, physical organic and computational chemistry. Further information can be viewed here.

""These books are the result of years of work, which began as an attempt to write a second edition of my 1976 book Frontier Orbitals and Organic Chemical Reactions. I wanted to give a rather more thorough introduction to molecular orbitals, while maintaining my focus on the organic chemist who did not want a mathematical account, but still wanted to understand organic chemistry at a physical level. I'm delighted to win this prize, and hope a new generation of chemists will benefit from these books." - Professor Ian Fleming"

Despite the growing interest in this new generation of water soluble carbon-chain polymers, there are few books available covering their physicochemical properties. Professor Kirsh has addressed this by writing a book which brings together data on their synthesis, properties and applications. The best known of the group is poly-N-vinylpyrrolidone (PVP), discovered in Germany in 1939, hence this book concentrates on PVP and the correlation of its properties with other poly-N-vinylamides. Poly-N-vinylamides are widely used in the creation of many synthetic polymeric materials and recent discoveries have increased their use in medicine and biotechnology. This book will therefore appeal to a wide readership from polymer and materials scientists, through to biotechnologists and those working in the pharmaceutical and cosmetics industries.

Radioastronomy has painted an extraordinary picture of the Galactic interstellar medium, which displays an amazing organization and structuring of matter from very hot ultra-diluted media to very cold denser milieus considered as the cradles of stars. In these latter environments, the discovery of a chemical diversity of molecules, including those associated with precursors to life itself, immediately brought to light the question of the mechanisms leading to their formation and persistence at temperatures as low as 10 K. The chemical networks developed to understand telescope observations required a great deal of physical and chemical parameters relevant to interstellar conditions, particularly at very low temperatures. These included the rate coefficients of thousands of gas phase chemical reactions. Such data were missing in the 1970s, when the very first molecular discoveries were made. Then, in the early eighties, it was realized that uniform supersonic flows were ideal chemical reactors to study reaction kinetics at interstellar temperatures.Uniform Supersonic Flows in Chemical Physics reviews 40 years of use of such reactors, the so-called CRESU machines, focusing on major breakthroughs brought to chemical physics, physical chemistry, astrophysics and astrochemistry by the various experiments carried out with such apparatuses. The wealth of kinetic data at very low temperatures provided new targets for the predictions of theory, with new theoretical methods being developed to explain observed behavior. The first two chapters describe the physical context of reaction kinetics at very low temperatures and the requirements needed to run optimally such uniform supersonic flows, together with a historical perspective. Chapters 3 to 9 describe the various families of chemical processes that have been explored within the CRESU technique, highlighting major advances and offering an exhaustive up-to-date bibliography. Chapters 10 and 11 show how these experimental results have helped in improving the ideas in quantum chemistry and interstellar modeling. The book concludes with an overview of potential perspectives and new routes to be explored.

An understanding of statistical thermodynamic molecular theory is fundamental to the appreciation of molecular solutions. This complex subject has been simplified by the authors with down-to-earth presentations of molecular theory. Using the potential distribution theorem (PDT) as the basis, the text provides an up-to-date discussion of practical theories in conjunction with simulation results. The authors discuss the field in a concise and simple manner, illustrating the text with useful models of solution thermodynamics and numerous exercises. Modern quasi-chemical theories that permit statistical thermodynamic properties to be studied on the basis of electronic structure calculations are given extended development, as is the testing of those theoretical results with ab initio molecular dynamics simulations. The book is intended for students taking up research problems of molecular science in chemistry, chemical engineering, biochemistry, pharmaceutical chemistry, nanotechnology and biotechnology.

- Covers topics such as fundamentals of electrochemistry for energy applications of COFs not covered in competing titles - Provides details about recent methods used for synthesis and characterization of COFs-based nanomaterials, particularly of energy applications - Covers the state-of-the-art development in COFs and their applications in green energy generation and storage - Widens fundamentals about COFs and mechanisms for realization and advancement in devices with improved energy efficiency and high storage capacity - Provides new directions to scientists, researchers, and students to better understand the principle, technologies, and applications of COFs

In recent decades, luminescent nanomaterials have generated great interest in the scientific community due to their unique properties, which are different from those of their bulk counterparts, and their use in a wide variety of applications. Today, luminescent nanomaterials are used in a number of applications such as displays, solid-state lighting, solar cells, long afterglow, dosimetry, theft prevention, medical imaging, phototherapy, and quantum and gas sensing. This book presents cutting-edge research from experts in the field of synthesis and characterization of luminescent nanomaterials and their potential applications. It covers interesting topics in semiconductor physics, photochemistry, physical chemistry, materials science, and luminescence, and will be useful for beginners and advanced researchers interested in this field.

This book presents tutorial overviews for many applications of variational methods to molecular modeling. Topics discussed include the Gibbs-Bogoliubov-Feynman variational principle, square-gradient models, classical density functional theories, self-consistent-field theories, phase-field methods, Ginzburg-Landau and Helfrich-type phenomenological models, dynamical density functional theory, and variational Monte Carlo methods. Illustrative examples are given to facilitate understanding of the basic concepts and quantitative prediction of the properties and rich behavior of diverse many-body systems ranging from inhomogeneous fluids, electrolytes and ionic liquids in micropores, colloidal dispersions, liquid crystals, polymer blends, lipid membranes, microemulsions, magnetic materials and high-temperature superconductors. All chapters are written by leading experts in the field and illustrated with tutorial examples for their practical applications to specific subjects. With emphasis placed on physical understanding rather than on rigorous mathematical derivations, the content is accessible to graduate students and researchers in the broad areas of materials science and engineering, chemistry, chemical and biomolecular engineering, applied mathematics, condensed-matter physics, without specific training in theoretical physics or calculus of variations.

Electroinduced Drift of Neutral Charge Clusters in Salt Solutions presents studies of the processes accompanying the effect of periodic electric and magnetic fields on salt solutions in polar dielectric liquids. The authors explain phenomena from a physical point of view, without theoretical constructions and mathematical calculations. This is done in order to make the book accessible to a wide audience and to help the reader navigate in a multilateral topic that is touched upon when studying processes that occur in liquid media under the external influence of an electromagnetic nature. Additional Features: Explores the phenomenon of selective drift of solvated ions in polar dielectric liquids Applies general principles of electricity and magnetism to describe experimental results Demonstrates how small perturbations of the equilibrium distribution determine not the corrections to the effects but the effects themselves Approaches nonequilibrium molecular physics as a science of physical and chemical processes This book will be useful to specialists, engineers and graduate students, especially those recording and transmitting information in liquid media.

Surface Structure Modification and Hardening of Al-SI Alloys explores the hardening of material surfaces using concentrated energy flows resulting in the nanostructuring of surface layers. The authors demonstrate how these methods achieve a reduction in plastic deformation of the surface and a more uniform distribution of elastic stresses near the surface during operational use, significantly reducing part failure. It presents results from research and scientific and technological enterprises involved with the modification of light alloy surfaces for use in the automobile and aerospace industries. Additional key features include: Addresses theoretical and experimental research computer simulations of structural phase transformations at the nanolevel to create new materials Details and compares electroexplosion alloying, electron beam processing and electron-plasma alloying of an Al-Si Alloy Explains multiphase plasma jet treatment to obtain high-quality coatings with good and high functional properties This reference is a valuable resource for specialists in the field of physical material science, condensed state physics, metal science and thermal treatment and will be of interest to undergraduate and post-graduate students in these fields.

This timely and unique publication is designed for graduate students and researchers in inorganic and materials chemistry and covers bonding models and applications of symmetry concepts to chemical systems. The book discusses the quantum mechanical basis for molecular orbital concepts, the connections between molecular orbitals and localized views of bonding, group theory, bonding models for a variety of compounds, and the extension of these ideas to solid state materials in band theory. Unlike other books, the concepts are made tangible to the readers by guiding them through their implementation in MATLAB functions. No background in MATLAB or computer programming is needed; the book will provide the necessary skills. Key Features Visualization of the Postulates of Quantum Mechanics to build conceptual understanding MATLAB functions for rendering molecular geometries and orbitals Do-it-yourself approach to building a molecular orbital and band theory program Introduction to Group Theory harnessing the 3D graphing capabilities of MATLAB Online access to a growing collection of applications of the core material and other appendices Bonding through Code is ideal for first-year graduate students and advanced undergraduates in chemistry, materials science, and physics. Researchers wishing to gain new tools for theoretical analysis or deepen their understanding of bonding phenomena can also benefit from this text. About the Author Daniel Fredrickson is a Professor in the Department of Chemistry at the University of Wisconsin-Madison, where his research group focuses on understanding and harnessing the structural chemistry of intermetallic phases using a combination of theory and experiment. His interests in crystals, structure, and bonding can be traced to his undergraduate research at the University of Washington (B.S. in Biochemistry, 2000) with Prof. Bart Kahr, his Ph.D. studies at Cornell University (2000-2005) with Profs. Stephen Lee and Roald Hoffmann, and his post-doctoral work with Prof. Sven Lidin at Stockholm University (2005-2008). As part of his teaching at UW-Madison since 2009, he has worked to enhance his department's graduate course, Physical Inorganic Chemistry I: Symmetry and Bonding, through the incorporation of new material and the development of computer-based exercises.

Lithium-ion batteries are the most promising among the secondary battery technologies, for providing high energy and high power required for hybrid electric vehicles (HEV) and electric vehicles (EV). Lithium-ion batteries consist of conventional graphite or lithium titanate as anode and lithium transition metal-oxides as cathode. A lithium salt dissolved in an aprotic solvent such as ethylene carbonate and diethylene carbonate is used as electrolyte. This rechargeable battery operates based on the principle of electrochemical lithium insertion/re-insertion or intercalation/de-intercalation during charging/discharging of the battery. It is essential that both electrodes have layered structure which should accept and release the lithium-ion. In advanced lithium-ion battery technologies, other than layered anodes are also considered. High cell voltage, high capacity as well as energy density, high Columbic efficiency, long cycle life, and convenient to fabricate any size or shape of the battery, are the vital features of this battery technology. Lithium-ion batteries are already being used widely in most of the consumer electronics such as mobile phones, laptops, PDAs etc. and are in early stages of application in HEV and EV, which will have far and wide implications and benefits to society. The book contains ten chapters, each focusing on a specific topic pertaining to the application of lithium-ion batteries in Electric Vehicles. Basic principles, electrode materials, electrolytes, high voltage cathodes, recycling spent Li-ion batteries and battery charge controller are addressed. This book is unique among the countable books focusing on the lithium-ion battery technologies for vehicular applications. It provides fundamentals and practical knowledge on the lithium-ion battery for vehicular application. Students, scholars, academicians, and battery and automobile industries will find this volume useful.

Inspired by a symposium held at the University of Southern California, in March 1988, dedicated to Paul van R. Schleyer, contributors examine the role of 'hypercarbons' in several areas of chemistry in this book. The multicenter bonding of 'hypercarbons' relative to the chemistry of main group elements, organometallics, cluster chemistry, carbocations, and hydrocarbon chemistry are systematically covered.

The Boundary Flux Handbook summarizes over 100 chemical compounds (single compounds, in mixed solution) and different feed streams from industry (complex streams exiting the agricultural, biological, pharmaceutical, food, dye, textile, and other industries) and the respective critical and threshold fluxes (or boundary flux), together with data on rejection and permeabilities. It gives the reader valuable data to quickly estimate membrane performances in respect to productivity, selectivity, and longevity, and aids in estimating capital and operating costs of membrane processes during the plant design operations. The book is valuable for scientific researchers and chemical engineers working with membrane technology as a reference for lab work, membrane process design, and control. For each specific feedstock, only the best performing membranes are listed. At least one commercial membrane module and a maximum of four different choices are reported, in order to assure easy integration of the proposed membranes into the systems by contacting the relevant commercial partner, and to define the best choice of the pretreatment steps, permitting quick membrane process optimization or revamping operations.

Vibrational Dynamics of Molecules represents the definitive concise text on the cutting-edge field of vibrational molecular chemistry. The chapter contributors are a Who's Who of world leaders in the field. The editor, Joel Bowman, is widely considered as one of the founding fathers of theoretical reaction dynamics. The included topics span the field, from fundamental theory such as collocation methods and vibrational CI methods, to interesting applications such as astrochemistry, supramolecular systems and virtual computational spectroscopy. This is a useful reference for theoretical chemists, spectroscopists, physicists, undergraduate and graduate students, lecturers and software developers.

Volume 1 of Formulation Science and Technology is a survey of the theory of formulations in a variety of fields, as well as their rheological characterization. It offers in-depth explanations for research scientists, universities, and industry practitioners looking for a complete understanding of how different formulations behave and how to influence their performance.

This book is a new edition of a classic text on experimental methods and instruments in surface science. It offers practical insight useful to chemists, physicists, and materials scientists working in experimental surface science. This enlarged second edition contains almost 300 descriptions of experimental methods. The more than 50 active areas with individual scientific and measurement concepts and activities relevant to each area are presented in this book. The key areas covered are: Vacuum System Technology, Mechanical Fabrication Techniques, Measurement Methods, Thermal Control, Delivery of Adsorbates to Surfaces, UHV Windows, Surface Preparation Methods, High Area Solids, Safety. The book is written for researchers and graduate students.

The primary goal of nanotechnology is to achieve nanoscale materials and devices with atomic precision. Toward this goal, breakthroughs have recently been made in the solution-phase synthesis and applications of atomically precise nanoclusters. This book presents the exciting progress in this new research field. The chapters are contributed by leading experts of the field and cover the synthetic methods, atomic structures, electronic and optical properties, and catalytic applications of noble metal nanoclusters. Such new nanocluster materials offer exciting opportunities for chemists and physicists to understand the fundamental science of nanoclusters, especially the atomic-level structure-property correlation and design of new materials, as well as for developing a range of applications including catalysis, biomedicine, sensing, imaging, optics, and energy conversion. The book will be of interest to readers and researchers in nanotechnology, nanochemistry, catalysis, and computational chemistry, as well as practitioners in industry R&D for new materials. It is written to be accessible to undergraduate and graduate students and, therefore, is an excellent teaching material.

Calculations in Chemical Kinetics for Undergraduates aims to restore passion for problem solving and applied quantitative skills in undergraduate chemistry students. Avoiding complicated chemistry jargon and providing hints and step wise explanations in every calculation problem, students are able to overcome their fear of handling mathematically applied problems in physical chemistry. This solid foundation in their early studies will enable them to connect fundamental theoretical chemistry to real experimental applications as graduates. Additional Features Include: Contains quantitative problems from popular physical chemistry references. Provides step by step explanations are given in every calculation problem. Offers hints to certain problems as "points to note" to enable student comprehension. Includes solutions for all questions and exercises. This book is a great resource for undergraduate chemistry students however, the contents are rich and useful to even the graduate chemist that has passion for applied problems in physical chemistry of reaction Kinetics.

Calculations in Chemical Kinetics for Undergraduates aims to restore passion for problem solving and applied quantitative skills in undergraduate chemistry students. Avoiding complicated chemistry jargon and providing hints and step wise explanations in every calculation problem, students are able to overcome their fear of handling mathematically applied problems in physical chemistry. This solid foundation in their early studies will enable them to connect fundamental theoretical chemistry to real experimental applications as graduates. Additional Features Include: Contains quantitative problems from popular physical chemistry references. Provides step by step explanations are given in every calculation problem. Offers hints to certain problems as "points to note" to enable student comprehension. Includes solutions for all questions and exercises. This book is a great resource for undergraduate chemistry students however, the contents are rich and useful to even the graduate chemist that has passion for applied problems in physical chemistry of reaction Kinetics.

This book describes medical applications of photochemistry. In the first part, a general introduction to photochemistry and related phototechnologies is provided. In the second part, photochemistry-based medical applications for diagnostics (biochips and bioimaging) and therapeutics (biomaterials for artificial organs, medical adhesives, dental materials, drug-delivery systems, tissue engineering, and photodynamic therapy) are described, with examples of recent research. The year 2015 is the International Year of Light and Light-Based Technologies. Light plays a vital role in our daily lives and is important in many interdisciplinary scientific fields in the twenty-first century. Light-based concepts have revolutionized medicine, including areas such as oncology, molecular biology, and surgery. Although photochemistry has contributed significantly to medicine directly and through photochemical fabrication of biomaterials, a book giving a comprehensive overview of recent progress has not been published until now. The aim of this book is to highlight the contributions of photochemistry in interdisciplinary fields of chemistry and medical engineering. This book will be useful for chemists who are interested in medical applications of photochemistry and engineers who are eager to learn the principles of photochemistry to enable its use in practical applications.

Compiled by an expert in the field, the book provides an engineer with data they can trust. Spanning gases, liquids, and solids, all critical properties (including viscosity, thermal conductivity, and diffusion coefficient) are covered.

From C1 to C100 organics and Ac to Zr inorganics, the data in this handbook is a perfect quick reference for field, lab or classroom usage. By collecting a large - but relevant - amount of information in one source, the handbook enables engineers to spend more time developing new designs and processes, and less time collecting vital properties data. This is not a theoretical treatise, but an aid to the practicing engineer in the field, on day-to-day operations and long range projects.
Simplifies research and significantly reduces the amount of time spent collecting properties data
Compiled by an expert in the field, the book provides an engineer with data they can trust in design, research, development and manufacturing.
A single, easy reference for critical temperature dependent properties for a wide range of hydrocarbons, including C1 to ClOO organics and Ac to Zr inorganics

From March 30th to April 3rd, 1992, a NATO Advanced Research workshop entitled "Time Dependent Quantum Molecular Dynamics: Theory and Experiment" was held at Snowbird, Utah. The organizing committee consisted of J. BROECKHOVE (Antwerp, Belgium), L. CEDERBAUM (Heidelberg, Germany), L. LATHOUWERS (Antwerp, Belgium), N. OHRN (Gainesville, Florida) and J. SIMONS (Salt Lake City, Utah). Fifty-two participants from eleven different countries attended the meeting at which thirty-three talks and one poster session were held. Twenty-eight participants submitted contributions to the proceedings of the meeting, which are reproduced in this volume. The workshop brought together experts in different areas 0 f molecular quantum dynamics, all adhering to the time dependent approach. The aim was to discuss and compare methods and applications. The ~amiliarityo~ the aUdience with the concepts o~ time dependent approaches greatly facilitated topical discussions and probing towards new applications. A broad area of subject matter was covered including time resolved laser chemistry, intramolecular dynamics, photodissociation dynamics, reactive and inelastic collisions as well as new time dependent methodologies. This diversity in applications is reflected in the contributions included in this volume .