Download or read book Theoretical Studies of Metal metal Cooperativity in Pyrazolate bridged Complexes written by Anton Römer and published by . This book was released on 2024 with total page 0 pages. Available in PDF, EPUB and Kindle. Book excerpt: Transition metal complexes can play a variety of important roles in regard to catalysis, materials synthesis, photochemistry, and biological systems through use of their unique electronic structure, and the resulting chemical versatility. These complexes can be tuned towards a multitude of different applications through careful design of their ligand structure. Electronic structure methods can provide great insight into these aspects, being able to predict compound properties even before any synthetic efforts have taken place, or in elucidating reaction mechanisms and unexplained compound b...
Download or read book Metal Ligand Interactions From Atoms to Clusters to Surfaces written by Dennis R. Salahub and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 428 pages. Available in PDF, EPUB and Kindle. Book excerpt: Metal-ligand interactions are currently being studied in different fields, from a variety of points of view, and recent progress has been substantial. Whole new classes of compounds and reactions have been found; an arsenal of physical methods has been developed; mechanistic detail can be ascertained to an increasingly minute degree; and the theory is being developed to handle systems of ever-growing complexity. As usual, such multidisciplinarity leads to great opportunities, coupled with great problems of communication between specialists. It is in its promotion of interactions across these fields that Metal-Ligand Interactions: From Atoms, to Clusters, to Surfaces makes its timely contribution: the tools, both theoretical and experimental, are highly developed, and fundamental questions remain unanswered. The most fundamental of these concerns the nature of the microscopic interactions between metal atoms (clusters, surfaces) and ligands (atoms, molecules, absorbates, reagents, products) and the changes in these interactions during physical and chemical transformation. In Metal-Ligand Interactions, leading experts discuss the following, vital aspects: ab initio theory, semi-empirical theory, density functional theory, complexes and clusters, surfaces, and catalysis.
Download or read book Metal Ligand Interactions written by N. Russo and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 595 pages. Available in PDF, EPUB and Kindle. Book excerpt: In September 2002, a NATO-ASI was held in Cetraro (CS), Italy on the theme of "Metal-Ligand Interactions in Molecular-, Nano-, Micro-, and Macro-systems in Complex Environments". This event has followed the previous ones held in the same place in 1991, 1994 and 1998. In the present and the previous schools a broad interdisciplinary cross-section of experimental and theoretical researchers, interested in a better understanding of metal-ligand interactions from different viewpoints, was linked together to exchange experience, to review the state-of-the-art, to indicate new techniques and methods, to explore new fields and perspectives. Particular emphasis was given to the problems related with the crossing from molecular systems to nano-, macro-and micro-scale materials and to the effects of the environment on the properties of the molecular systems. The school was organized around lectures and special research seminares given by leading experts in the following fields: • metal clusters • inorganic complexes and materials • surface phenomena • adsorption and catalysis • organic and bio-inorganic systems • ab initio theory • density functional theory • classical and quantum dynamics This volume contains the formal lectures and selected contributed papers and describes the main aspects and problems tackled during the 12 days of the event.
Download or read book Theoretical Studies of Transition Metal ligand Multiple Bond Complexes written by Paul Dermot Lyne and published by . This book was released on 1993 with total page 0 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Preorganized Bimetallic Nickel Complexes of Pyrazolate bridged Ligands for Cooperative Substrate Transformation written by Dennis-Helmut Manz and published by . This book was released on 2016 with total page 0 pages. Available in PDF, EPUB and Kindle. Book excerpt: This thesis focuses on square-planar, pyrazolate-bridged dinuclear platforms to investigate their reactivity towards small molecules. In the scope of this work two ligands were prepared: a pyrrole-pyrazole based (H3Lpyr) and a bis-[beta]-diketiminate-pyrazole based system (H3Lbisnac). Both of these hexadentate, trianionic ligands provide two binding pockets to accommodate transition metals. Use of nickel-salts gave rise to a variety of preorganized dinuclear nickel(II) complexes containing a small exogenous ligand serving as a bridging unit between the two metal cations. Each of these complexes ...
Download or read book Theoretical Studies of Ligand bridged Transition metal Dinuclear Organometallic Compounds and the Synthesis and Structure Determination of Bis n cyclopentadienyl bis benzoato titanium IV written by David Maurice Hoffman and published by . This book was released on 1982 with total page 524 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Metal Ligand Interactions written by N. Russo and published by Springer. This book was released on 1996 with total page 574 pages. Available in PDF, EPUB and Kindle. Book excerpt: A sequel to the June 1991 NATO ASI on "Metal-Ligand Interactions: From Atoms to Clusters to Surfaces," the present September 1994 ASI focused more on reactivity and its structural dependence. Hence, it emphasized experimental determinations of structure and dynamics supported by the theoretical and computational approaches needed to establish the concepts and guide the experiments. These proceedings are based on the lectures presented in the areas of clusters, inorganic complexes, surfaces, catalysis, ab initio theory, density functional theory, semiempirical methods, and dynamics. Annotation copyright by Book News, Inc., Portland, OR
Download or read book Theoretical Studies of the Bonding in Some Organotransition Metal Fragments and Clusters written by Albert Brownlee Rives and published by . This book was released on 1981 with total page 480 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Studies of Metal metal Bonded and Ligand Bridged IVB Metal transitionmetal Complexes written by Joseph A. Abys and published by . This book was released on 1981 with total page 560 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Theoretical Studies of Some Third Row Transition Metal Complexes written by Charles Bonner Harris and published by . This book was released on 1966 with total page 368 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Theoretical Studies on the Chemical Characteristics of Transition Metal Complexes written by Kazuyuki Tatsumi and published by . This book was released on 1976 with total page 0 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Synthetic Structural and Stability Studies of Metal Complexes of Cross bridged Tetraamine Macrocycles written by Weijun Niu and published by . This book was released on 2003 with total page 652 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Theoretical and Spectroscopic Studies of Mid first Row Transition Metal Complexes written by Kathlyn L. Fillman and published by . This book was released on 2016 with total page 217 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Metal metal Cooperativity in the Reactions of Heterobimetallic Complexes written by David Michael Antonelli and published by . This book was released on 1991 with total page 412 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Metal Organic Frameworks written by Leonard R. MacGillivray and published by John Wiley & Sons. This book was released on 2010-12-17 with total page 440 pages. Available in PDF, EPUB and Kindle. Book excerpt: Metal-organic frameworks represent a new class of materials that may solve the hydrogen storage problem associated with hydrogen-fueled vehicles. In this first definitive guide to metal-organic framework chemistry, author L. MacGillivray addresses state-of-art developments in this promising technology for alternative fuels. Providing professors, graduate and undergraduate students, structural chemists, physical chemists, and chemical engineers with a historical perspective, as well as the most up-to-date developments by leading experts, Metal-Organic Frameworks examines structure, symmetry, supramolecular chemistry, surface engineering, metal-organometallic frameworks, properties, and reactions.
Download or read book Directory of Graduate Research written by American Chemical Society. Committee on Professional Training and published by . This book was released on 1979 with total page 1030 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Computational Methods in Organometallic Catalysis written by Yu Lan and published by John Wiley & Sons. This book was released on 2021-06-28 with total page 50 pages. Available in PDF, EPUB and Kindle. Book excerpt: Computational Methods in Organometallic Catalysis Discover recent advances in the mechanistic study of organometallic catalysis In Computational Methods in Organometallic Catalysis: From Elementary Reactions to Mechanisms, distinguished chemist and author Yu Lan delivers a synthesis of the use of calculation methods and experimental techniques to improve the efficiency of reaction and yield of product and to uncover the factors that control the selectivity of product. Providing not only a theoretical overview of organometallic catalysis, the book also describes computational studies for the mechanism of transition-metal-assisted reactions. You’ll learn about Ni-, Pd-, Pt-, Co-, Rh-, Ir-, Fe-, Ru-, Mn-, Cu-, Ag-, and Au- catalysis. You’ll also discover many of the experimental and theoretical advances in organometallic catalysis reported in the recent literature. The book summarizes and generalizes the advances made in the mechanistic study of organometallic catalysis. Readers will also benefit from the inclusion of: A thorough introduction to computational organometallic chemistry, including a brief history of the discipline and the use of computational tools to study the mechanism of organometallic chemistry An exploration of computational methods in organometallic chemistry, including density functional theory methods and basis sets and their application in mechanism studies A practical discussion of elementary reactions in organometallic chemistry, including coordination and dissociation, oxidative addition, reductive elimination, insertion, elimination, transmetallation, and metathesis A concise treatment of the theoretical study of transition-metal catalysis. Perfect for organic, catalytic, complex, and structural chemists, Computational Methods in Organometallic Catalysis will also earn a place in the libraries of theoretical chemists seeking a one-stop organometallic catalysis resource with a focus on the mechanism of transition-metal-assisted reactions.
