Transition metal catalysis belongs to the most important chemical research areas because a ubiquitous number of chemical reactions are catalyzed by transition metal compounds. Many efforts are being made by industry and academia to find new and more efficient catalysts for chemical processes. Transition metals play a prominent role in catalytic research because they have been proven to show an enormous diversity in lowering the activation barrier for chemical reactions. For many years, the search for new catalysts was carried out by trial and error, which was costly and time consuming. The understanding of the mechanism of the catalytic process is often not very advanced because it is difficult to study the elementary steps of the catalysis with experimental techniques. The development of modern quantum chemical methods for calculating possible intermediates and transition states was a breakthrough in gaining an understanding of the reaction pathways of transition metal catalyzed reactions. This volume, organized into eight chapters written by leading scientists in the field, illustrates the progress made during the last decade. The reader will obtain a deep insight into the present state of quantum chemical research in transition metal catalysis.

Silicon Based Polymers presents highlights in advanced research and technological innovations using macromolecular organosilicon compounds and systems, as presented in the 2007 ISPO congress. Silicon-containing materials and polymers are used all over the world and in a variety of industries, domestic products and high technology applications.

Among them, silicones are certainly the most well-known, however there are still new properties discovered and preparative processes developed all the time, therefore adding to their potential. Less known, but in preparation for the future, are other silicon containing-polymers which are now close to maturity and in fact some are already available like polysilsesquioxanes and polysilanes.

All these silicon based materials can adopt very different structures like chains, dendrimers, hyperbranched and networks, physical and chemical gels. The result is a vast array of materials with applications in various areas such as optics, electronics, ionic electrolytes, liquid crystals, biomaterials, ceramics and concrete, paints and coatings ... all needed to face the environmental, energetical and technological issues of today. Some industrial aspects of the applications of these materials will also be presented.

Light alkanes tend to be resistant to many forms of activation. The horizontal approach of the present book covers homogeneous, heterogeneous and biological catalysis, thus allowing readers to gain an awareness of progress and ideas in research areas different from their own. The book contains both general chapters, giving an overview of the subject, and specialised contributions that deal with the details and state of the art. A specialist report is also included which gives a critical insight into current progress and discusses future prospects and major challenges. Audience: Newcomers and senior researchers in the field of alkane activation. The mixed theoretical and practical approach will be of interest to researchers and industrialists alike.

Chemistry of Powder Production focuses on the solid-state chemistry of powder materials and relates this to the structure, properties and preparation, and characterization techniques for these important industrial products. Additionally, the properties of the particles are discussed in relation to their surface structure and characteristics. This book describes the fundamentals of statistical methods for measuring the characteristics of particles. New advanced materials being developed in powder technology manufacturing techniques are also emphasised, including powdered materials for advanced ceramics as well as magnetic and pigment materials.

In every generation the achievements in science have served mankind. The progress accomplished by one generation stimulates the next generation to even greater achievements, which may take the form of increasing, crystallizing, or detailing existing theo- ries. Other forms, generally resulting from persistence and enlight- ened fortune, open new areas of investigation previously unimagined and have an impact that may be felt for many years. An example of this latter form of achievement was the prepara- tion and elucidation of the structures of dicyclopentadienyliron (ferrocene, reported in 1951) dibenzenechromium iodide, triphenyl- chromium tristetrahydrofuranate, and numerous olefin-metal -com- plexes which provided an introduction to new types of chemical bonds- the sigma carbon-transition metal bond and the metal -complex bond. Initial progress in the field of organotransition-metal chemis- try followed the lines of interest generated separately by organic and inorganic chemistry. However, it is becoming increasingly clear that organotransit10n-metal chemistry is not only bridging these two fields, but also crosslinking many other fields of science.

To the eyes of a chemist, carbon is certainly one of the most fascinating elements of the periodic table. Basically, the electronic structure and atomic size of carbon enables this element to form a variety of bonds with other elements and, most importantly, with other carbon atoms as weIl. These unique features lead to the amazingly complicated molecular structures we encounter e. g. in life sciences and organic chemistry. Of course, the technical importance of carbon is enormou- but I don't want to carry too many coals to Newcastle. Prom the viewpoint of an astrophysicist or chemist, the significance of carbon lies in the fact that it is the most abundant condensable element in space. Born in the interior of stars, and from there expelled into the interstellar medium, it initiates the formation of simple and complex molecules and of nanoscopic grains. These in turn form huge clouds in space - the birthplace of new stars and planetary systems. The decisive role of carbon in interstellar chemistry is widely accepted and the search for more and more families of interstellar carbon-bearing molecules is a topic of ongoing research. The interdisciplinary aspect of carbon also concerns its various solid forms, in which C and the other closed-cage fullerenes are certainly some of the most popular 60 newcomers.

Computational molecular and materials modeling has emerged to deliver solid technological impacts in the chemical, pharmaceutical, and materials industries. It is not the all-predictive science fiction that discouraged early adopters in the 1980s. Rather, it is proving a valuable aid to designing and developing new products and processes. People create, not computers, and these tools give them qualitative relations and quantitative properties that they need to make creative decisions.
With detailed analysis and examples from around the world, Applying Molecular and Materials Modeling describes the science, applications, and infrastructures that have proven successful. Computational quantum chemistry, molecular simulations, informatics, desktop graphics, and high-performance computing all play important roles. At the same time, the best technology requires the right practitioners, the right organizational structures, and - most of all - a clearly understood blend of imagination and realism that propels technological advances. This book is itself a powerful tool to help scientists, engineers, and managers understand and take advantage of these advances.

Most descriptions of polymers start at room temperature and end at the melting point. This textbook starts at very low temperatures and ends at room temperature. At low temperatures, may processes and relaxations are frozen which allows singular processes or separate relaxations to be studied. At room temperatures, or at the main glass transitions, many processes overlap and the properties are determined by relaxations. At low temperatures, there are temperature ranges with negligible influences by glass transitions. They can be used for investigating so-called basic properties which arise from principles of solid state physics. The chain structure of polymers, however, requires stringent modifications for establishing solid state physics of polymers. Several processes which are specific of polymers, occur only at low temperatures. There are also technological aspects for considering polymers at low temperatures. More and more applications of polymeric materials in low temperature technology appear. Some examples are thermal and electrical insulations, support elements for cryogenic devices, low-loss materials for high frequency equipments. It is hoped that, in addition to the scientific part, a data collection in the appendix may help to apply polymers more intensively in low temperature technology. The author greatly appreciates the contributions by his coworkers of the Kernforschungszentrum Karlsruhe in measurement and discussion of many data presented in the textbook and its appendix. Fruitful disccussions with the colleagues Prof. H. Baur, Prof. S. Hunklinger, Prof. D. Munz and Prof. R."

Biological inorganic chemistry is a field of research at the interface of inorganic and biological chemistry. The rapidly developing insights into the role of metals in biological systems has far-reaching implications not only for biological science but also for related disciplines, ranging from molecular medicine to the environment. In each volume the reader, whether engaged in chemistry, biochemistry, biology or molecular medicine, receives a comprehensive summary and critical overview of a topic of high current interest written by leading international experts.

Extractions of Metals from Soils and Waters represents a new emphasis in the series Modern Inorganic Chemistry, namely the impact inorganic chemistry can have on the environment. Also, this is the first volume ever to introduce the reader to all aspects of heavy metal extraction. While the primary emphasis is on complexation chemistry, attention is also paid to phase transfer aspects. Particular methods of note include electrokinetics, phytoremediation, and sensors. Aimed primarily at chemists, this book will also appeal to engineers, plant biochemists, environmental health specialists, and practitioners or students of environmental law.

"Metal Catalysed Reactions in Ionic Liquids" is the first non-edited book on the subject of metal catalyzed reactions in ionic liquids to cover the literature from its origins until early 2005.
Following a general introduction to the field of biphasic/multiphasic catalysis, the book moves on to describe the synthesis, the functionalisation, and fundamental properties of ionic liquids relevant to catalysis. It then analyses the catalysed reactions according to their type, encompassing hydrogenation, hydroformylation, oxidation, C-C coupling reactions, metathesis, dimerisation, polymerisation and more. Trends, generalisations, advantages and disadvantages of ionic liquids for specific reaction types are also examined as well as specific processes such as supported ionic liquid phase catalysis, continuous processes using CO2 extraction and nanoparticle catalysis.
"Metal Catalysed Reactions in Ionic Liquids" is of interest to those working in catalysis/green chemistry, in particular to advanced level undergraduate and graduate students and researchers in bi- or multiphasic catalysis using ionic liquids.
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Theory Instrumentation NIR analysis of sediment samples Uses of NIRS in palaeolimnology Future perspectives Summary References Fly-ash particles. Neil Rose 319 12. Introduction A brief history Methods of extraction and enumeration Temporal distribution Spatial distribution Source apportionment The future Summary Acknowledgements References Part III: Stable Isotope Techniques 13. Application of stable isotope techniques to inorganic and biogenic carbonates. Emi Ito 351 Introduction Nomenclature and systematics of lake-water Mg/Ca and Sr/Ca ratios of lake-water of dissolved inorganic carbon (DIC) Carbonates in lake-sediments Mollusks Ostracodes Charaphytes Isotope analysis Preparation of carbonate samples for isotope analysis Conclusions Summary Acknowledgments References 14. Carbon and oxygen isotope analysis of lake sediment cellulose: methods and applications. Brent B. Wolfe, Thomas W. D. Edwards, Richard J. Elgood & Kristina R. M. Beuning 373 xi Introduction Stable isotope tracers in lake Historical development Methods Key criteria for paleohydrologic reconstruction Applications Future research directions Summary Acknowledgements References Nitrogen isotopes in palaeolimnology. Michael R. Talbot 15. 401 Introduction Nitrogen in lakes: forms and distribution Nitrogen isotopes Nitrogen isotope studies in palaeolimnology: sampling and measurement Some examples Closing remarks Summary Acknowledgments References Glossary, acronyms and abbreviations 441 Index 493 xiii PREFACE The explosive growth of paleolimnology over the past two decades has provided impetus for the publication of this series of monographs detailing the numerous advances and new techniques being applied to the interpretation of lake histories. This is the second volume in the series and deals mainly with physical and geochemical analytical techniques.

Computational Modelling of Homogeneous Catalysis is an extensive collection of recent results on a wide array of catalytic processes. The chapters are, in most cases, authored by the researchers who have performed the calculations. The book illustrates the importance of computational modelling in homogeneous catalysis by providing up-to-date reviews of its application to a variety of reactions of industrial interest, including:

-olefin polymerization;
-hydrogenation;
-alkene/alkyne isomerization;
-hydroformylation;
-hydroboration; hydrosylation;
-dihydroxylation;
-benzannulation;
-epoxidation;
-N-N triple bond activation.

This book facilitates understanding by experimental chemists in the field on what has already been accomplished and what can be expected from calculations in the near future. In addition, the book provides computational chemists with a first-hand knowledge on the state of the art in this exciting field.

Aluminum, bound almost exclusively to oxygen in various combinations, is the most abundant metal in the earth's crust and, therefore, of great commercial potential. Once methods were developed (in the 1880's) to free useable quantities of the element from oxygen, applications for the element began developing rapidly. This growth has resulted in the ubiquity of the metal in today's world. Therefore it can be found intentionally introduced in many products in direct contact with human beings. It is commonly known that soluble forms of aluminum aretoxic to living organisms. However, aluminum is not known to be bioavailable under everyday conditions. In fact, the solubility product of common aluminum compounds, such as AI(OH)3 is so low as to make it essentially unavailable. This volume of Structure and Bonding seeks to provide in one source, a resource where the basic science related to aluminum toxicity may be obtained. It should be stressed that this volume is not intended to be a warning to avoid contact with aluminum. Living organisms have adequate defenses to prevent aluminum toxicity under normal conditions. Rather the volume was created to simply provide an understanding of the biological effects of aluminum. As such, the present volume should be considered in the context of the companion volumes in this three part series of Structure and Bonding. The first volume was devoted to fundamental developments in group 13 chemistry.

Despite more than 200 years of sulfur research the chemistry of elemental sulfur and sulfur-rich compounds is still full of "white spots" which have to be filled in with solid knowledge and reliable data. This situation is parti- larly regrettable since elemental sulfur is one of the most important raw - terials of the chemical industry produced in record-breaking quantities of ca. 35 million tons annually worldwide and mainly used for the production of sulfuric acid. Fortunately, enormous progress has been made during the last 30 years in the understanding of the "yellow element." As the result of extensive inter- tional research activities sulfur has now become the element with the largest number of allotropes, the element with the largest number of binary oxides, and also the element with the largest number of binary nitrides. Sulfur, a typical non-metal, has been found to become a metal at high pressure and is even superconducting at 10 K under a pressure of 93 GPa and at 17 K at 260 GPa, respectively. This is the highest critical temperature of all chemical elements. Actually, the pressure-temperature phase diagram of sulfur is one of the most complicated of all elements and still needs further investigation.

"Polymineral-Metasomatic Crystallogenesis" is dedicated to the foundations of polymineral crystallogenesis in solutions typically occurring in nature. Effects, laws, and mechanisms of a metasomatic crystal replacement, joint crystal growth of different phases, mixed crystal formation, and aggregate re-crystallization as well as oriented overgrowth (epitaxy and quasi-epitaxy) and crystal habit origin are considered experimentally. The behaviour of these processes in nature are discussed in addition to pseudomorphs, poikilitic crystals (and other replacement forms), features of rapakivi structure, fluorite morphology, and many more. The concept is a generalization of the classic theory on crystallogenesis which is complicated by phase interaction in polymineral systems.

"Polymineral-Metasomatic Crystallogenesis" is designed for chemists, geologists, physicists, and postgraduates and advanced undergraduate students of these fields.

Polyolefin is a major industry that is important for our economy and impacts every aspect of our lives. The discovery of new transition metal-based catalysts is one of the driving forces for the further advancement of this field. Whereas the classical heterogeneous Ziegler-Natta catalysts and homogeneous early transition metal metallocene catalysts remain the workhorses of the polyolefin industry, in roughly the last decade, tremendous progress has been made in developing non-metallocene-based olefin polymerization catalysts. Particularly, the discovery of late transition metal-based olefin polymerization catalysts heralds a new era for this field. These late transition metal complexes not only exhibit high activities rivaling their early metal counterparts, but more importantly they offer unique properties for polymer architectural control and copolymerization with polar olefins. In this book, the most recent major breakthroughs in the development of new olefin polymerization catalysts, including early metal metallocene and non-metallocene complexes and late transition metal complexes, are discussed by leading experts. The authors highlight the most important discoveries in catalysts and their applications in designing new polyolefin-based functional materials.

The design of efficient syntheses of medicinal agents is one of the prime goals of the process chemist in the pharmaceutical industry. The expanding list of metal-mediated reactions has had a major impact on this endeavor over the last two decades. This volume will highlight some of the areas of organometallic chemistry that have played a particularly important role in development. The chapters are written by chemists who work in the process groups of major pharmaceutical companies and fine chemical manufacturers. Having demonstrated the power of organometallics in their processes the authors herein expand upon their experiences with examples from the literature as reported by process groups within the industry. The chapters are organized either by the application of a particular metal or reaction class. Removal of the residual metal(s) from the isolated active pharmaceutical ingredient (API) is key to the release of the material for human consumption, and hence, is reviewed here as well. This volume of Topics in Organometallic Chemistry is presented to offer a representative cross section of organometallic applications in the pharmaceutical industry as well as to give an appreciation for the creativity possible in process chemistry.

Organized to facilitate reference to the reagents involved, this book describes the reactions of the elements and their mostly simpler compounds, primarily inorganic ones and primarily in water. The book makes available some of the more comprehensive coverage of descriptive aqueous chemistry found in older sources, but now corrected and interpreted with the added insights of the last seven decades.

Binary Rare Earth Oxides is the first book in the field of rare earth oxides that provides coverage from the basic science through to recent advances. This book introduces the unique characteristics of the binary rare earth oxides with their chemistry, physics and applications. It provides a comprehensive review of all the characteristics of rare earth oxides, essential for scientists and engineers involved with rare earths, oxides, inorganic materials, ceramics, and structures. The binary rare earth oxides bring us a variety of interesting characteristics. Understanding their fundamental mechanisms builds a bridge between solid-state chemistry and materials science.

The book begins with a brief introduction to binary rare earth oxides, their physical and chemical stabilities, polymorphism, crystal structures and phase transformation and the association with current applications. The book goes on to present the band structure of the oxides using several quantum chemical calculations, which belong to a newly developed area in the binary rare earth oxides. Central to this chapter are the characterizations of electrical, magnetic and optical properties, as well as details of single crystal growth and particle preparation methods that have progressed in recent years. Later chapters concentrate on thermo-chemical properties and trace determination techniques. The final chapter contains a variety of useful applications in various fields such as phosphors, glass abrasives, automotive catalysts, fuel cells, solid electrolytes, sunscreens, iron steels, and biological materials.
This book is an invaluable resource for materials scientists and solid-state physicists and chemists with an interest in rare earth oxides, as well as advanced students and graduates who require an approach to familiarize them with this field. This book provides guidance through a comprehensive review of all the characteristics of binary rare earth oxides.

This Volume is based on the Lectures presented at the Meeting "Chemistry at the Beginning of the Third Millennium," wh ich was held in Pavia, Italy, during the period 7-10 October, 1999. The Meeting involved the participation of scientists from German and ltalian Universities of the 'Coimbra Group'. The 'Coimbra Group', wh ich was founded in 1987, gathers the most ancient and prestigious European Universities, with the aim to promote initiatives in both research and teaching and to provide guidelines for the progress and development of the University system. German and Italian Universities within the Coimbra Group propose every year a theme for scientific discussion, which originates a Meeting to be held in a German or Italian University. The Meeting in Pavia was the fifth of the series and followed those of Bologna (1995), Jena (1996), Siena (1997), Heidelberg (1998). Each Meeting is centred on a topic from either humanistic or natural sciences and consists in aseries of lectures presented by distinguished scientists from the six participanting Universities. For the Pavia Meeting, the Steering Committee chose Chemistry as the topic and gathered researchers with experience in almost all fields of chemistry. In particular, during the Meeting, lectures were presented on many up-to-date subjects of chemistry, including: materials science, superconductors, supramolecular chemistry, bioinorganic chemistry, fullerenes, liquid crystals, photoinduced electron transfer, etc. The different topics were covered by distinguished and renown researchers of the various fields.

The present issue of Structure and Bonding is dedicated to applied group 13 chemistry, particularly for the elements boron and aluminum, and to a lesser degree gallium and indium. Although boron is a trace element (0.01 g kg 1) in the earth's crust, it has been concentrated in a few locations by geochemical processes and is relatively easy to mine as borax. Aluminum, on the other hand, is the most abundant metal in the earth's crust (82 g kg 1) and dispersed widely throughout the globe. Thus, boron and aluminum are readily available and their associated products or compounds are usually inexpensive and thereby easy to commercialize. The chapters were chosen to encompass both applied and fundamental aspects of their subiects. The first chapter 'Borates in Industrial Use' provides a complete, and perhaps, quintessential, coverage of compounds containing boron oxygen bonds. In the chapter Schubert explains the close relationship between the basic properties of the boron compounds and their associated uses. The remaining four chapters focus, to some degree, on aluminum. Since a great deal of literature exists in this area, these chapters are more focused on areas of emerging utility, and contain a great deal of fundamental information. Uhl's contribution in Chapter 2 provides basic synthesis and structural information for aluminum and gallium hydrazides. These types of compounds are being explored as potential molecular precursors to metal nitrides such as the important blue green laser material gallium nitride.

Fundamental QSARs for Metal Ions describes the basic and essential applications of quantitative structure-activity relationships (QSARs) for regulatory or industrial scientists who need to predict metal ion bioactivity. It includes 194 QSARs that have been used to predict metal ion toxicity and 86 QSARs that have been used to predict metal ion bioconcentration, biosorption, and binding. It is an excellent sourcebook for academic, industrial, and government scientists and policy makers, and provides a wealth of information on the biological and chemical activities of metal ions as they impact health and the environment. Fundamental QSARs for Metal Ions was designed for regulatory and regulated organizations that need to use QSARs to predict metal ion bioactivity, as they now do for organic chemicals. It has the potential to eliminate resources to test the toxicity of metal ions or to promulgate regulations that require toxicity testing of metal ions because the book illustrates how to construct QSARs to predict metal ion toxicity. In addition, the book: Provides a historical perspective and introduction to developing QSARs for metal ions Explains the electronic structures and atomic parameters of metals essential to understanding differences in chemical properties that influence cation toxicity, bioconcentration, biosorption, and binding Describes the chemical properties of metals that are used to develop QSARs for metal ions Illustrates the descriptors needed to develop metal ion-ligand binding QSARs Discusses 280 QSARs for metal ions Explains the differences between QSARs for metal ions and Biotic Ligand Models Lists the regulatory limits of metals and provides examples of regulatory applications Illustrates how to construct QSARs for metal ions Dr. John D. Walker is the winner of the 2013 SETAC Government Service Award.

Remarks by JVS. Volumes 1 and 2 of Feldspar Minerals were published in 1974, but Volume 3 was not completed because I was forced to devote 3 years to the resolution of unforeseen problems in the construction of an ion probe. By 1977, the incomplete draft for Volume 3 had become obsolete because of the enormous advances in knowledge of feldspars, particularly those in lunar rocks and meteorites, and in both deep-seated and ancient terrestrial rocks. Furthermore, it soon became obvious that a completely new version of Feldspar Minerals was needed because of the important new results on the physical and chemical properties. I had kept up with the interesting but tedious chore of weekly reading of the incoming literature and maintenance of the files. By 1980, the intense day-to day pressure had gone from my research programs on lunar rocks and on the development of the ion microprobe as a quantitative geochemical instrument, and I began preparation of a second edition of Feldspar Minerals."