"Annual Reports in Computational Chemistry" provides timely and critical reviews of important topics in computational chemistry as applied to all chemical disciplines. Topics covered include quantum chemistry, molecular mechanics, force fields, chemical education, and applications in academic and industrial settings. Focusing on the most recent literature and advances in the field, each article covers a specific topic of importance to computational chemists.
Quantum chemistryMolecular mechanicsForce fieldsChemical education and applications in academic and industrial settings

This book is aimed at advanced undergraduates, graduate students and other researchers who possess an introductory background in materials physics and/or chemistry, and an interest in the physical and chemical properties of novel materials, especially transition metal oxides. New materials often exhibit novel phenomena of great fundamental and technological importance. Contributing authors review the structural, physical and chemical properties of notable 4d- and 5d-transition metal oxides discovered over the last 10 years. These materials exhibit extraordinary physical properties that differ significantly from those of the heavily studied 3d-transition metal oxides, mainly due to the relatively strong influence of the spin- orbit interaction and orbital order in 4d- and 5d materials. The immense growth in publications addressing the physical properties of these novel materials underlines the need to document recent advances and the current state of this field. This book includes overviews of the current experimental situation concerning these materials.

The large number of new antitumour antibiotics that have been discovered and evaluated since the first volume of "The Chemistry of Antitumour Antibiotics" was published in 1978 are described in this up-to-date work. It covers the results of mode and action studies which have benefitted from high-field NMR, including 2-D techniques, computer modelling and DNA sequencing methods. The volume also notes how biosynthesis has been helped by NMR to follow the incorporation of compounds containing stable isotopes.

"Transforming Your STEM Career Through Leadership and Innovation" offers valuable information on what it means to be a leader and innovator and encourages you to discover and develop these skills for yourself. This book integrates leadership and innovation principles with personal examples and profiles of inspirational women. By providing a clear process on how to build upon your personal strengths to realize leadership and innovation goals, this book will inspire you to pick up the mantle and meet the critical need for leadership and innovation in the STEM fields. This is a must-have guide that is relevant and valuable for women in all stages of their careers.
Examines research-based leadership and innovation principles to make these critically important characteristics both real and attainableEmpowers you to build upon your own strengths and successes to discover and develop leadership and innovation skillsFeatures a companion website that highlights women s leadership success stories, innovation resources and best practicesProvides a practical guide that educates, encourages and equips you to pursue leadership and innovation opportunities
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As in the previous volume on the topic, the authors close the gap between abstract mathematical approaches, such as applied methods of modern algebra and analysis, fundamental and computational mechanics, nonautonomous and stochastic dynamical systems, on the one hand and practical applications in nonlinear mechanics, optimization, decision making theory and control theory on the other. Readers will also benefit from the presentation of modern mathematical modeling methods for the numerical solution of complicated engineering problems in biochemistry, geophysics, biology and climatology. This compilation will be of interest to mathematicians and engineers working at the interface of these fields. It presents selected works of the joint seminar series of Lomonosov Moscow State University and the Institute for Applied System Analysis at National Technical University of Ukraine "Kyiv Polytechnic Institute". The authors come from Brazil, Germany, France, Mexico, Spain, Poland, Russia, Ukraine and the USA.

The field of nanoscience continues to grow at an impressive rate, with over 10,000 new articles a year contributing to a literature of more than half a million citations. Such a vast landscape of material requires careful searching to discover the most important discoveries. The newest edition to the Specialist Periodical Reports presents a digest of the last twelve months of the literature across the field. The volume editor, Professor Paul O'Brien (University of Manchester, UK) has drawn on some of the most active researchers to present critical and comprehensive reviews of the hottest topics in the field. Chapters include "Nanomaterials for solar energy", "Magnetic hyperthermia", and "Graphene and graphene-based nanocomposites". There is also a special chapter on "Nanoscience in India". Anyone practicing in any nano-allied field, or wishing to enter the nano-world will benefit from the comprehensive resource, which will be published annually.

A GUIDE TO THE DESIGN, OPERATION, CONTROL, TROUBLESHOOTING, OPTIMIZATION AS WELL AS THE RECENT ADVANCES IN THE FIELD OF PETROCHEMICAL PROCESSES Efficient Petrochemical Processes: Technology, Design and Operation is a guide to the tools and methods for energy optimization and process design. Written by a panel of experts on the topic, the book highlights the application of these methods on petrochemical technology such as the aromatics process unit. The authors describe practical approaches and tools that focus on improving industrial energy efficiency, reducing capital investment, and optimizing yields through better design, operation, and optimization. The text is divided into sections that cover the range of essential topics: petrochemical technology description; process design considerations; reaction and separation design; process integration; process system optimization; types of revamps; equipment assessment; common operating issues; and troubleshooting case analysis. This important book: Provides the basic knowledge related to fundamentals, design, and operation for petrochemical processes Applies process integration techniques and optimization techniques that improve process design and operations in the petrochemical process Provides practical methods and tools for industrial practitioners Puts the focus on improving industrial energy efficiency, reducing capital investment, and optimizing yields Contains information on the most recent advances in the field. Written for managers, engineers, and operators working in process industries as well as university students, Efficient Petrochemical Processes: Technology, Design and Operation explains the most recent advances in the field of petrochemical processes and discusses in detail catalytic and adsorbent materials, reaction and separation mechanisms.

A comprehensive introduction to the emerging field of nonequilibrium thermodynamics

Nonequilibrium thermodynamics has emerged as a promising new field of study dealing with irreversible processes in matter, and is fundamental to understanding these systems on a wide range of length scales, including the micro- or nanoscopic level. Many of the most cutting-edge technological applications within this field require a fully nonlinear framework far from equilibrium. To create a unified framework that accommodates such needs, author Hans Christian ִtinger presents a new paradigm--beyond equilibrium thermodynamics.

In addition to being based on the latest developments, Beyond Equilibrium Thermodynamics is itself a significant development in the field. This groundbreaking text presents the first comprehensive approach to thermodynamics and statistical methods far from equilibrium. It clearly explains physical concepts, describes mathematics, and presents problems and solutions. In defining the new paradigm of beyond equilibrium thermodynamics, this book has the potential for opening a new field in the study of irreversible processes.

The text features: A presentation based on a unified framework A comprehensive list of applications of nonequilibrium thermodynamics An introduction to simulation techniques--a key to future applications Systematic classification of beyond equilibrium simulation techniques Guidance in anticipating the logical structure of results before actually deriving them Inclusion of a covariant version of the thermodynamic framework for relativistic applications More than 200 exercises with detailed solutions Careful referencing, including section or pagenumbers

Suitable for use as a graduate-level teaching tool or a reference for working scientists, Beyond Equilibrium Thermodynamics provides a concrete understanding of what had previously been a largely abstract field.

The new edition of this widely-used sourcebook details the startlingly array of diagnostic equipment available in the medical laboratory of the nineties, and also covers maintenance and quality assurance for each type of instrument. This book includes 17 completely rewritten chapters and 7 new ones, on nephelometry and turbidimetry, gas chromatography, mass spectrometry, flow cytometry, automated immunoassay systems, automated blood bank systems, and physician's office laboratory instrumentation.

Air pollution related to the release of industrial toxic gases, represents one of the main
concerns of our modern world owing to its detrimental effect on the environment. To tackle this growing issue, efficient ways to reduce/control the release of pollutants are required. Adsorption of gases on porous materials appears as a potential solution. However, the physisorption of small molecules of gases such as ammonia is limited at ambient conditions. For their removal, adsorbents providing strong adsorption forces must be used/developed.
In this study, new carbon-based materials are prepared and tested for ammonia adsorption at ambient conditions. Characterization of the adsorbents texture and surface chemistry is performed before and after exposure to ammonia to identify the features responsible for high adsorption capacity and for controlling the mechanisms of retention. The characterization techniques include: nitrogen adsorption, thermal analysis, potentiometric titration, FT-IR spectroscopy, X-ray diffraction, Energy Dispersive X-ray spectroscopy, X-ray photoelectron spectroscopy and Electron Microscopy. The results obtained indicate that ammonia removal is governed by the adsorbent s surface chemistry. On the contrary, porosity (and thus physisorption) plays a secondary role in this process, unless strong dispersive forces are provided by the adsorbent. The surface chemistry features responsible for the enhanced ammonia adsorption include the presence of oxygen-(carboxyl, hydroxyl, epoxy) and sulfur- (sulfonic) containing groups. Metallic species improve the breakthrough capacity as well as they lead to the formation of Lewis acid-base interactions, hydrogen-bonding or complexation. In addition to the latter three mechanisms, ammonia is retained on the adsorbent surface via Bronsted acid-base interactions or via specific reactions with the adsorbent s functionalities leading to the incorporation of ammonia into the adsorbent s matrix. Another mechanism involves dissolution of ammonia in water when moisture is present in the system. Even though this process increases the breakthrough capacity of a material, it provides rather weak retention forces since ammonia dissolved in water is easily desorbed from the adsorbent s surface."

Chemical analysis moves from laboratory to places where samples to be analysed are located. This trend is aptly termed "on-site analysis". As the dictum says: "from sample transfer to information transfer". Owing to the ever increasing number of samples to be analysed, preliminary screening and selection of samples seems to be necessary, even in the laboratory. Rapid test methods of chemical analysis can solve both these tasks. This book is devoted to test methods that are widely used in environmental, industrial, clinical, forensic, medical, and other areas allowing a rapid, simple and cost-effective analysis - qualitative, semi-quantitative and quantitative to be performed by trained as well as non-trained personnel. Some general characteristic features of test methods and test systems are described in the book, e.g. definitions, advantages and limitations, chemical and physical principles of operation, procedures and protocols, and methodological aspects. Application of test methods in various areas is extensively overviewed, and the test means and test tools pertinent for solving each concrete analytical task are discussed, e.g. paper strips, indicator powders and tubes, tablets, etc. The most important applications of test methods, evidently, are: testing for inorganic and organic components in water (mostly for purposes of environmental control), monitoring of toxic gases and alcohol vapours, detection of narcotics and explosives, determination of glucose, cholesterol, and other components of medical importance.

Carbohydrate Chemistry provides review coverage of all publications relevant to the chemistry of monosaccharides and oligosaccharides in a given year. The amount of research in this field appearing in the organic chemical literature is increasing because of the enhanced importance of the subject, especially in areas of medicinal chemistry and biology. In no part of the field is this more apparent than in the synthesis of oligosaccharides required by scientists working in glycobiology. Clycomedicinal chemistry and its reliance on carbohydrate synthesis is now very well established, for example, by the preparation of specific carbohydrate- based antigens, especially cancer-specific oligosaccharides and glycoconjugates. Coverage of topics such as nucleosides, amino-sugars, alditols and cyclitols also covers much research of relevance to biological and medicinal chemistry. Each volume of the series brings together references to all published work in given areas of the subject and serves as a comprehensive database for the active research chemist Specialist Periodical Reports provide systematic and detailed review coverage in major areas of chemical research. Compiled by teams of leading authorities in the relevant subject areas, the series creates a unique service for the active research chemist, with regular, in-depth accounts of progress in particular fields of chemistry. Subject coverage within different volumes of a given title is similar and publication is on an annual or biennial basis.

Chemistry, Seventh Edition provides the necessary practice, support, concept mastery and individualized instruction that ensure success in the General Chemistry course.

The unique "chemical tools" approach employed in this book provides a way of thinking that helps readers develop the ability to analyze and solve both mathematical and conceptual problems.

New to This Edition:

• Completely revised end-of-chapter problem sections
• Chapter Openers include more real-world relevance/connections
• New Chapter 0 provides optional “refresher” information for students about the history of chemistry: coverage of the elements, atomic structure, and theory.
• New Analyzing & Solving Multi-Concept problems and examples have been added throughout the text. These problem and examples are also now briefer and more concise.
• New Learning Objectives have been added to provide an outline at the beginning of each chapter.
• New End-of-Chapter Summaries review key chapter concepts, also organized by Learning Objectives.

The Wiley Advantage

• WileyPLUS is a research-based online environment for effective teaching and learning. WileyPLUS is packed with interactive study tools and resources–including the complete online textbook–to give your students more value for their money.
• WileyPLUS is now equipped with an adaptive learning module called ORION. Based on cognitive science, WileyPLUS with ORION, provides students with a personal, adaptive learning experience so they can build their proficiency on topics and use their study time most effectively. WileyPLUS with ORION helps students learn by learning about them.
• Analyzing and Solving Multi-Concept Problems
• Four-step problem solving framework: “Analysis”, “Solution”, “Assembling the Tools”, and “Is the Answer Reasonable?”
• Tools for Problem Solving – basic skills are presented as tools (marked by icons) that can be combined in a variety of ways to solve complex problems
• End of chapter problems feature more visuals/molecular structures and provide a wide range of difficulty.