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  • Fragmentation: Toward Accurate Calculations on Complex Molecular Systems

    Edición de Mark S. Gordon ...
    Fragmentation: Toward Accurate Calculations on Complex Molecular Systems introduces the reader to the broad array of fragmentation and embedding methods that are currently available or under development to facilitate accurate calculations on large, complex systems such as proteins, polymers, liquids and nanoparticles. These methods work by subdividing a system into subunits, called fragments or ... Leer más

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  • Mathematics for Physical Chemistry

    Mathematics for Physical Chemistry is the ideal supplementary text for practicing chemists and students who want to sharpen their mathematics skills while enrolled in general through physical chemistry courses. This book specifically emphasizes the use of mathematics in the context of physical chemistry, as opposed to being simply a mathematics text. This 4e includes new exercises in each chapter ... Leer más

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  • Introduction to Corrosion Science

    Series series Chemistry and Material Science (R0)
    This textbook is intended for a one-semester course in corrosion science at the graduate or advanced undergraduate level. The approach is that of a physical chemist or materials scientist, and the text is geared toward students of chemistry, materials science, and engineering. This textbook should also be useful to practicing corrosion engineers or materials engineers who wish to enhance their ... Leer más

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  • Electrochemistry of Carbon Electrodes

    Series series Advances in Electrochemical Sciences and Engineering
    The book sets the standard on carbon materials for electrode design. For the first time, the leading experts in this field summarize the preparation techniques and specific characteristics together with established and potential applications of the different types of carbon-based electrodes. An introductory chapter on the properties of carbon together with chapters on the electrochemical ... Leer más

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  • The Art of Molecular Dynamics Simulation

    The extremely powerful technique of molecular dynamics simulation involves solving the classical many-body problem in contexts relevant to the study of matter at the atomistic level. Since there is no alternative approach capable of handling this extremely broad range of problems at the required level of detail, molecular dynamics methods have proved themselves indispensable in both pure and ... Leer más

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  • Homogeneous Catalysis with Renewables

    Series series Chemistry and Material Science (R0)
    This volume gives a detailed account into how renewables can be transformed into value-added products via homogeneous catalysis, especially via transiton metal homogeneous catalysis. The most important catalytic reactions of oleochemicals, isoprenoids, carbohydrates, lignin, proteins and carbon dioxide are described. Special emphasis is placed on carbon-carbon linkage reactions (hydroformylations, ... Leer más

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  • Chemical Processes in Atmospheric Oxidation

    Laboratory Studies of Chemistry Related to Tropospheric Ozone

    Edición de Georges Le Bras ...
    Series series Earth and Environmental Science (R0)
    Oxidation and removal of atmospheric constituents involve complex sequences of reactions which can lead to the production of photo-oxidants such as ozone. In order to understand and model these complex reaction sequences, it is necessary to have a comprehensive understanding of reaction mechanisms and accurate estimates of kinetic parameters for relevant gas-phase atmospheric reactions. This book ... Leer más

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  • Surface Modification of Polymeric Biomaterials

    Series series Chemistry and Material Science (R0)
    Applications of synthetic materials in medicine date back over 4000 year2. The Egyptians used linen as sutures. In the Roman Empire, gold was used in dentistry. Perhaps even earlier, ivory and bone may have been used in the body by practitioners of the healing arts. The historical origins of modem biomaterials science are also hard to precisely trace, but many of the ideas that define biomaterials ... Leer más

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  • A Handbook of Magnetochemical Formulae

    de Roman Boča ...
    Magnetochemistry is concerned with the study of magnetic properties in materials. It investigates the relationship between the magnetic properties of chemical compounds and their atomic and molecular structure. This rapidly growing field has a number of applications, and the measuring and interpreting of magnetic properties is often conducted by scientists who are not specialists in the field. ... Leer más

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  • Gravity, Special Relativity, and the Strong Force

    A Bohr-Einstein-de Broglie Model for the Formation of Hadrons

    Series series Chemistry and Material Science (R0)
    This book shows that the strong interaction forces, which keep hadrons and nuclei together, are relativistic gravitational forces exerted between very small particles in the mass range of neutrinos. First, this book considers the motion of two or three charged particles under the influence of electrostatic and gravitational forces only, which shows that bound states are formed by following the ... Leer más

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  • Automotive Battery Technology

    Series series Engineering (R0)
    The use of electrochemical energy storage systems in automotive applications also involves new requirements for modeling these systems, especially in terms of model depth and model quality. Currently, mainly simple application-oriented models are used to describe the physical behavior of batteries. This book provides a step beyond of state-of-the-art modeling showing various different approaches ... Leer más

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  • Multiconfigurational Quantum Chemistry

    The first book to aid in the understanding of multiconfigurational quantum chemistry, Multiconfigurational Quantum Chemistry demystifies a subject that has historically been considered difficult to learn. Accessible to any reader with a background in quantum mechanics and quantum chemistry, the book contains illustrative examples showing how these methods can be used in various areas of chemistry, ... Leer más

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