This volume highlights the recent advances and state of art in the experimental and theoretical studies of organometallic magnets. A plethora of organic ligands such as Mannich-base derivatives, redox-active chromophores, cyanides, Schiff base among others are used to coordinate to 3d transition metals, 4f lanthanides and 5f actinides to design the molecular magnets. Deep analysis of the coordination sphere symmetry, electronic distribution, luminescence are investigated to perform magneto-structural correlation leading to a better understanding of the magnetic properties. Furthermore, the rationalization of the magnetic behavior can be reached using ab initio calculations. The multiple applications that these molecular magnets offer could revolutionize the high-density data storage, spintronics and quantum computing technologies. This volume provides a discussion of these topics from leading international experts and will be a useful reference for researchers working in this field.

The book provides an in-depth discussion regarding inorganic ion exchangers for students, teachers, and researchers engaged in conducting research in chemical technology and related areas. Analytical chemists seeking simple and novel means of using easy-to-prepare chromatographic materials will find this book extremely informative. Inorganic Ion Exchangers in Chemical Analysis is unique in its discussion of column and planar chromatographic applications of amorphous synthetic inorganic ion exchangers. The book also covers the historical background of iorganic ion exchangers, their classification and present status, and the analytical aspects of these materials.

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.

It has long been recognized that metal spin states play a central role in the reactivity of important biomolecules, in industrial catalysis and in spin crossover compounds. As the fields of inorganic chemistry and catalysis move towards the use of cheap, non-toxic first row transition metals, it is essential to understand the important role of spin states in influencing molecular structure, bonding and reactivity. Spin States in Biochemistry and Inorganic Chemistry provides a complete picture on the importance of spin states for reactivity in biochemistry and inorganic chemistry, presenting both theoretical and experimental perspectives. The successes and pitfalls of theoretical methods such as DFT, ligand-field theory and coupled cluster theory are discussed, and these methods are applied in studies throughout the book. Important spectroscopic techniques to determine spin states in transition metal complexes and proteins are explained, and the use of NMR for the analysis of spin densities is described. Topics covered include: * DFT and ab initio wavefunction approaches to spin states * Experimental techniques for determining spin states * Molecular discovery in spin crossover * Multiple spin state scenarios in organometallic reactivity and gas phase reactions * Transition-metal complexes involving redox non-innocent ligands * Polynuclear iron sulfur clusters * Molecular magnetism * NMR analysis of spin densities This book is a valuable reference for researchers working in bioinorganic and inorganic chemistry, computational chemistry, organometallic chemistry, catalysis, spin-crossover materials, materials science, biophysics and pharmaceutical chemistry.

This book presents the recent advances in the field of nanoscale science and engineering of ferroelectric thin films. It comprises two main parts, i.e. electrical characterization in nanoscale ferroelectric capacitor, and nano domain manipulation and visualization in ferroelectric materials. Well known le'adingexperts both in relevant academia and industry over the world (U.S., Japan, Germany, Switzerland, Korea) were invited to contribute to each chapter. The first part under the title of electrical characterization in nanoscale ferroelectric capacitors starts with Chapter 1, "Testing and characterization of ferroelectric thin film capacitors," written by Dr. I. K. Yoo. The author provides a comprehensive review on basic concepts and terminologies of ferroelectric properties and their testing methods. This chapter also covers reliability issues in FeRAMs that are crucial for commercialization of high density memory products. In Chapter 2, "Size effects in ferroelectric film capacitors: role ofthe film thickness and capacitor size," Dr. I. Stolichnov discusses the size effects both in in-plane and out-of-plane dimensions of the ferroelectric thin film. The author successfully relates the electric performance and domain dynamics with proposed models of charge injection and stress induced phase transition. The author's findings present both a challenging problem and the clue to its solution of reliably predicting the switching properties for ultra-thin ferroelectric capacitors. In Chapter 3, "Ferroelectric thin films for memory applications: nanoscale characterization by scanning force microscopy," Prof. A."

This is not a book on NO biology, nor about hemoglobin, nor about heme-based sensors per se. Of course, it covers all these topics and more, but above all, it aims at providing a truly multidisciplinary perspective of heme-diatomic interactions. The overarching goal is to build bridges among disciplines, to bring about a meeting of minds.
The contributors to this book hail from diverse university departments and disciplines chemistry, biochemistry, molecular biology, microbiology, zoology, physics, medicine and surgery, bringing with them very different views of heme-diatomic interactions. The hope is that the juxtaposition of this diversity will lead to increased exchanges of ideas, approaches, and techniques across traditional disciplinary boundaries.
The authors represent a veritable Who s Who of heme protein research and include John Olson, Tom Spiro, Walter Zumft, F. Ann Walker, Teizo Kitagawa, W. Robert Scheidt, Pat Farmer, Marie-Alda Gilles-Gonzalez, and many other equally distinguished scientists.

Extremely distinguished list of authors
Multidisciplinary character equally suitable for chemists and biochemists
Covers the hottest topics in heme protein research: sensors, NO biology, new roles of hemoglobin, etc."

Optical Spectroscopy of Lanthanides: Magnetic and Hyperfine Interactions represents the sixth and final book by the late Brian Wybourne, an accomplished pioneer in the spectroscopy of rare earth ions, and Lidia Smentek, a leading theoretical physicist in the field. The book provides a definitive and up-to-date theoretical description of spectroscopic properties of lanthanides doped in various materials.

The book integrates computer-assisted calculations developed since Wybourne's classic publication on the topic. It contains useful Maple(TM) routines, discussions, and new aspects of the theory of f-electron systems. Establishing a unified basis for understanding state-of-the-art applications and techniques used in the field, the book reviews fundamentals based on Wybourne's graduate lectures, which include the theory of nuclei, the theory of angular momentum, Racah algebra, and effective tensor operators. It then describes magnetic and hyperfine interactions and their impact on the energy structure and transition amplitudes of the lanthanide ions. The text culminates with a relativistic description of "f"↔"f" electric and magnetic dipole transitions, covering sensitized luminescence and a new parametrization scheme of f-spectra.

Optical Spectroscopy of Lanthanides enables scientists to construct accurate and reliable theoretical models to elucidate lanthanides and their properties. This text is ideal for exploring a range of lanthanide applications including electronic data storage, lasers, superconductors, medicine, nuclear engineering, and nanomaterials.

Breakthrough research and innovative science . . .

PROGRESS in Inorganic Chemistry

Nowhere is creative scientific talent busier than in the world of inorganic chemistry. This fascinating series provides the field of inorganic chemistry with a forum for critical and authoritative evaluations of advances in every area of the discipline. With contributions from internationally renowned chemists, this latest volume of Progress in Inorganic Chemistry continues to report the most recent advances with an innovative, cutting-edge style.

"This series is distinguished not only by its scope and breadth, but also by the depth and quality of the reviews."
–Journal of the American Chemical Society

"[This series] has won a deservedly honored place on the bookshelf of the chemist attempting to keep afloat in the torrent of original papers on inorganic chemistry."
–Chemistry in Britain

CONTENTS OF VOLUME 49

• Nonclassical Metal Carbonyls
  (Anthony J. Lupinetti and Steven H. Strauss, Colorado State University, Fort Collins, Colorado, and Gernot Frenking, Philipps-Universitat Marburg, Germany)
• The Influence of Ligands on Dirhodium(II) on Reactivity and Selectivity in Metal Carbene Reactions
  (Michael P. Doyle, University of Arizona, Tucson, Arizona, and Tong Ren, University of Miami, Coral Gables, Florida)
• Coordination Chemistry of Transition Metals with Hydrogen Chalcogenide and Hydrochalcogenido Ligands
  (Maurizio Peruzzini and Isaac De Los Rios, Instituto per lo Studio della Stereochimica ed Energetica dei Composti de Coordinazione, CNR, Firenze, Italy, and Antonio Romerosa, Universidad de Almeria, Spain)
• The Coordination Chemistry of Phosphinines, Their Polydentate and Macrocyclic Derivatives
  (Nicolas Mézailles, François Mathey, and Pascal le Floch, École Polytechnique, Palaiseau Cedex, France)
• Texaphyrins: Synthesis and Development of a Novel Class of Therapeutic Agents
  (Tarak D. Mody and Lei Fu, Pharmacyclics, Inc., Sunnyvale, California, and Jonathan L. Sessler, University of Texas at Austin, Texas)
• The Chemistry of Synthetic Fe-Mo-S Clusters and Their Relevance to the Structure and Function of the Fe-Mo-S Center in Nitrogenase
  (Steve M. Malinak, Albion College, Michigan, and Dimitri Coucouvanis, University of Michigan, Ann Arbor, Michigan)

Advances in Fluorine Science presents critical multidisciplinary overviews for areas in which fluorine and fluoride compounds have a decisive impact. The individual volumes of Advances in Fluorine Science are thematic, addressing comprehensively both the science and applications on topics including the Environment, Green chemistry, Medicine, Health & Life Sciences, New Technologies & Materials Science, Energy and the Earth Sciences.
For each subject the contributors will clearly inform the reader on the nature of the problem (if any) and on the solutions, combining knowledge from different scientific disciplines, that have been proposed to solve each issue.
This volume covers a wide scope of important issues about our atmospheric environment and contains contributions from both chemists and environmental scientists. Articles review the origin of fluorine-emissions either from natural or anthropogenic origin; the chemistry of fluorine- and halogen-based species in the atmosphere; the monitoring and characterization of atmospheric pollutants; new generations of halocarbons and improved destruction procedures of banned CFCs; the role of fluorides within both our geosphere: volcanic magmas and natural fluorine emissions, and effects on our biosphere: life cycle, plants and animals.
* Examines the role of fluorine and fluoride products in our environment: from the geosphere to the atmosphere through the biosphere
* Discusses the efforts of scientists and industry groups towards the improvement of environmental and sustainability issues
* Multidisciplinary contributions from chemists, geologists, biologists, environmentalists and industry staffs

This unique book presents an integrated approach to the chemistry of art materials, exploring the many chemical processes involved. The Chemistry and Mechanism of Art Materials: Unsuspected Properties and Outcomes engages readers with historical vignettes detailing examples of unexpected outcomes due to materials used by known artists. The book discusses artists' materials focusing on relevant chemical mechanisms which underlie the synthesis and deterioration of inorganic pigments in paintings, the ageing of the binder in oil paintings, and sulfation of wall paintings as well as the toxicology of these pigments and solvents used by artists. Mechanisms illustrate the stepwise structural transformation of a variety of art materials. Based on the author's years of experience teaching college chemistry, the approach is descriptive and non-mathematical throughout. An introductory section includes a review of basic concepts and provides concise descriptions of analytical methods used in contemporary art conservation. Additional features include: Illustrations of chemical reactivity associated with art materials Includes a review of chemical bonding principles, redox and mechanism writing Covers analytical techniques used by art conservation scientists Accessible for readers with a limited science background Provides numerous references for readers seeking additional information

The introduction of carbon - fluorine bonds into organic compounds can profoundly influence their chemical and physical properties when compared to their non-fluorine containing analogues, leading to a range of man-made materials with highly desirable properties. These molecules are of interest across the wide spectrum of industrial and academic organic chemistry, from pharmaceuticals, through fine and specialty chemicals to polymers. From Prozac to Teflon, many of the most important products of the chemical and life-science industries rely on organic fluorine chemistry for their useful properties. In this new book the author, internationally known for his contribution to organic fluorine chemistry, covers both the preparative methodologies and chemical properties of partially and highly fluorinated organic systems. Written as an authoritative guide to the subject for organic chemists in universities and the pharmaceutical, agrochemical, specialty organic and polymer industries, the book will also be an important resource for university advanced courses. Dick Chambers is a Fellow of the Royal Society and Emeritus Professor of Chemistry at the University of Durham, Durham, UK.

This work provides a how-to approach to the fundamentals, methodologies and dynamics of computational organometallic chemistry, including classical and molecular mechanics (MM), quantum mechanics (QM), and hybrid MM/QM techniques. It demonstrates applications in actinide chemistry, catalysis, main group chemistry, medicine, and organic synthesis.

High surface area, a microporous structure, and a high degree of surface reactivity make activated carbons versatile adsorbents, particularly effective in the adsorption of organic and inorganic pollutants from aqueous solutions. Activated Carbon Adsorption introduces the parameters and mechanisms involved in the activated carbon adsorption of organic and inorganic compounds. This text brings together the most significant research on surface structure and processes, adsorption theories and isotherm equations, and applications from the latest literature on carbon adsorption. The book clearly explains the surface-related interactions of activated carbons, their energetics, and the applicability of adsorption isotherm equations and their deviation from adsorption data. It then explores numerous applications in a wide range of areas, such as nuclear technology, vacuum technology, food technology, pharmaceuticals and medicine, gas storage, oil refining, and environmental remediation. Topics include: oils and fats, molecular sieves, refining of liquid fuels, pesticides, dyes, drugs, and toxins. Three chapters are dedicated to environmental applications, including the adsorption of halogenated organic compounds and the removal of hazardous gases and vapors, organo-sulphur compounds, and other inorganic compounds from wastewater and groundwater. Activated Carbon Adsorption presents a complete survey of the growing number of state-of-the-art applications supported by a compilation of the latest perspectives in research concerning carbon surfaces and their adsorption processes from aqueous solutions. Its unified approach promotes further research towards improving and developing newer activated carbon adsorbents and processes for the efficient removal of pollutants from drinking water and industrial effluents.

Hydrogen is widely billed as the fuel of the future. For this to be a reality there is a pressing need for a safe, economic and reliable way to transport hydrogen, particularly for automotive applications. This has prompted a world-wide effort to develop novel materials that are re-usable and capable of storing and releasing significant (> 6 wt%) quantities of hydrogen. In addition to compressed (either liquid or gaseous) hydrogen, two main themes are being explored: adsorption of hydrogen by materials and "chemical hydrogen" where hydrogen is reacted with a material. The discussion will focus on both themes, from synthesis and characterisation to application of such novel materials. The focus will be on the wider issues involved in synthetic routes, characterisation, materials properties, rather than simply on examples. The importance of the interplay of theory and experiment will be stressed. Faraday Discussion 151, organised by the Faraday Division, aims to bring together the diverse range of workers in the field of hydrogen storage materials, from those involved in materials discovery and characterisation, to those studying mechanisms or developing applications. The Discussion will both inform people of alternative strategies and encourage new ideas and approaches. The themes cover: -Application of theory and spectroscopic methods to understand hydrogenation/dehydrogenation mechanisms -Novel approaches such as catalysed hydrogenation/dehydrogenation of organic molecules, encapsulation of nanosized materials in carbon or polymers -Chemical hydrogen: characterisation and properties of main group and transition metal borohydrides and alanates, ternary and quaternary metal hydrides, reactive hydride composites -Adsorbed/physisorbed hydrogen on or in MOFs, promoted carbons and other materials with large internal or external surface area -Applications including uses for automotives and novel battery materials

This book describes drug metal-ion interactions in the gut and deals with the deficiency of zinc and iron and their pharmacological use. It covers anti-inflammatory activities of copper and gold complexes and considers the role of metal ions and chelating agents in anti-viral chemotherapy.

In the literature of continuous flow analysis, there are hundreds of descriptions of problems encountered with the various AutoAnalyzer modules. This volume presents the way these have been used in conjunction with chromatographic separations and manufacturing plant process monitoring systems.

The International Workshop "New sources, novel phases, new applications," the third of the series on "Oxide based materials," was held September 13 to 16, 2004 at Societa del Casino Sociale in Como, Italy. The workshop brought together experimental and theoretical scientists of different origins and expertise to exchange information on common scientific research fields, especially on all those materials whose features and properties depend on the interaction between surface and ionic and/or molecular species. Knowledge of familiar materials was compared and experiences shared on a varied range of different materials, often new materials, including metal oxides, zeolites and other microporous compounds, mesoporous silicates and silica, hybrid inorganic-organic compounds, soil aggregates, layered materials, and bioactive glasses.
* Brings together experimental and theoretical information
* Provides information on new oxide-based materials with applications in catalysis, pollution control and nanoengineering
* Contributions from experts in the field

This book provides a fundamental understanding of the basis of the theoretical treatment of electronic properties in graphite. It illustrates the wide range of topics of interest to researchers on carbon materials and stimulates further understanding of some of the phenomena involved.

This publication presents cleaning and etching solutions, their applications, and results on inorganic materials. It is a comprehensive collection of etching and cleaning solutions in a single source. Chemical formulas are presented in one of three standard formats - general, electrolytic or ionized gas formats - to insure inclusion of all necessary operational data as shown in references that accompany each numbered formula. The book describes other applications of specific solutions, including their use on other metals or metallic compounds. Physical properties, association of natural and man-made minerals, and materials are shown in relationship to crystal structure, special processing techniques and solid state devices and assemblies fabricated. This publication also presents a number of organic materials which are widely used in handling and general processing...waxes, plastics, and lacquers for example. It is useful to individuals involved in study, development, and processing of metals and metallic compounds. It is invaluable for readers from the college level to industrial R & D and full-scale device fabrication, testing and sales. Scientific disciplines, work areas and individuals with great interest include: chemistry, physics, metallurgy, geology, solid state, ceramic and glass, research libraries, individuals dealing with chemical processing of inorganic materials, societies and schools.

"Written as a complement to the definitive work selenium in the Environment (Marcel Dekker, Inc.). Presents basic and the most recent applied research developments in selenium remediation-emphasizing field investigations as well as covering topics from analytical methods and modeling to regulatory aspects from federal and state perspectives. "

In the fields of biologically active materials and functional materials, fluorinated organic materials are becoming a focus of significant interest. Over the past decade synthetic methodologies and reagents in fluorine chemistry have been developed, especially stereocontrolled synthetic methods, enzymatic resolution to synthesize enantiomers, fluoromethylated reagents, and fluorination reagents. These methods have contributed to the opening of new pathways for fluorinated materials. However, few fluorinated materials have been put to commercial use. Furthermore, there remain problems to be solved, such as the handling of the materials, availability of reagents and selectivity (stereo-, regio-, and/or chemoselectivity). Research chemists, technical engineers, and graduate students in all branches of chemistry, pharmaceutics, and material science interested in fluorinated materials need to know detailed experimental procedures of how to synthesize the target fluorinated materials. This volume summarizes the chemical and microbial methods for obtaining functionalized fluorinated materials for use as building blocks; detailed experimental methods (reaction conditions, solvent, temperature, handling techniques, etc.); and the stereoview (possible absolute configuration) of the structures with spectral data. Mono-, di-, tri-, and polyfluorinated materials derived from fluorinating agents, fluoromethylated reagents and building blocks are summarized. A chemical name index, molecular formula index, and reagent index are also included. The publication of this monograph will provide access to the enormous possibilities in fluorine chemistry, biological material chemistry, and functionalized material chemistry.

Volume 1 of this work presents theory and methods to study the structure of condensed matter on different time scales. The authors cover the structure analysis by X-ray diffraction methods from crystalline to amorphous materials, from static-relaxed averaged structures to short-lived electronically excited structures, including detailed descriptions of the time-resolved experimental methods. Complementary, an overview of the theoretical description of condensed matter by static and time-dependent density functional theory is given, starting from the fundamental quantities that can be obtained by these methods through to the recent challenges in the description of time dependent phenomena such as optical excitations. Contents Static structural analysis of condensed matter: from single-crystal to amorphous DFT calculations of solids in the ground state TDDFT, excitations, and spectroscopy Time-resolved structural analysis: probing condensed matter in motion Ultrafast science

This book covers one of the most neglected areas in environmental trace analysis, namely that of sample preparation. The text discusses all of the necessary steps for analysing a sample for both trace metals and organics, from the initial sampling protocols, through the range of possible sample preparation methods, and leading finally to the analysis and recording of data. Detailed information is provided on the specific methods to follow for preparing a sample for metal and organic analyses.

The topics covered include the following:

• Basic laboratory skills

• Investigative approaches for sample preparation

• Sampling

• Storage of samples

• Sample preparation for inorganic analysis - solids and liquids

• Sample preparation for organic analysis - solids, liquids and volatile compounds

• Pre-concentration approaches

• Instrumental techniques for trace analysis

• Up-to-date information on the latest developments in sample preparation for metals and organics.

• Written in an open learning/distance learning style, it is ideal for use as a self-study guide or as the basis of a taught course.

• The provision of a comprehensive bibliography to guide the reader to more specialized texts and sources.

"Highlights the availability of magnesium to organisms, its uptake and transport in microorganisms and plants as well as its role in health and disease of animals and humans including its toxicology."

Humans first used carbon as chars from firewood in ritual paintings and primitive metallurgical processes. Natural forms of carbon have been known since antiquity, yet the knowledge of the carbon element in chemistry and its technical applications on a larger scale are a relatively recent development. The industrial revolution in Europe two centuries ago led the way to the numerous applications of these graphitic forms that are still used today. Graphite and Precursors features short tutorial articles on different topics related to the science and technology of carbons intended for engineers, students of Materials Science and scientists who are seeking a fundamental understanding without "reinventing the wheel." This first volume of the World of Carbon book series focuses on graphite and its precursors, including its origin and various implications. The basic properties of hexagonal graphite are developed, and several theoretical and experimental approaches explain why this crystalline solid is fascinating in solid state physics. Also featured are the numerous applications connected to thermal, mechanical and chemical graphites, as well as their various industrial uses in polycrystalline form. Finally, carbon precursors are introduced.