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« ross c walker »

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  • Electronic Structure Calculations on Graphics Processing Units

    From Quantum Chemistry to Condensed Matter Physics

    Modifié par Ross C. Walker, Andreas W. Goetz ...
    Electronic Structure Calculations on Graphics Processing Units: From Quantum Chemistry to Condensed Matter Physics provides an overview of computing on graphics processing units (GPUs), a brief introduction to GPU programming, and the latest examples of code developments and applications for the most widely used electronic structure methods.The book covers all commonly used basis sets including ... En savoir plus

    $184.99 CAD

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  • Molecular Orbitals and Organic Chemical Reactions

    par Ian Fleming ...
    Winner of the PROSE Award for Chemistry & Physics 2010Acknowledging the very best in professional and scholarly publishing, the annual PROSE Awards recognise publishers' and authors' commitment to pioneering works of research and for contributing to the conception, production, and design of landmark works in their fields. Judged by peer publishers, librarians, and medical professionals, Wiley are ... En savoir plus

    $67.99 CAD

  • Environmental Aspects of Trace Elements in Coal

    Modifié par D.J. Swaine, F. Goodarzi ...
    Collections Livre 2 - Energy & Environment
    Happy he who could learn the causes of things (Virgil, Georgics 11) There is clearly a place for a book on the environmental aspects of trace elements in coal, especially with the increasing use of coal for power production. Our aim is to provide relevant background information and to update the situation regarding trace elements during beneficiation, combustion, .atmospheric deposition, leaching ... En savoir plus

    $256.99 CAD

  • Time-Dependent Density-Functional Theory

    Concepts and Applications

    par Carsten A. Ullrich ...
    Collections series Oxford Graduate Texts
    Time-dependent density-functional theory (TDDFT) describes the quantum dynamics of interacting electronic many-body systems formally exactly and in a practical and efficient manner. TDDFT has become the leading method for calculating excitation energies and optical properties of large molecules, with accuracies that rival traditional wave-function based methods, but at a fraction of the ... En savoir plus

    $35.69 CAD

  • Bond Orders and Energy Components

    Extracting Chemical Information from Molecular Wave Functions

    par István Mayer ...
    While modern computational methods can provide us with the wave function of a molecule in numerical form, most computer programs lack the sophisticated tools needed to extract chemical concepts from these wave functions. Saving researchers vast time and potential confusion, this volume collects and organizes those validated tools currently scattered throughout the literature and details their ... En savoir plus

    $147.99 CAD

  • The Tunnel Effect in Chemistry

    par Ronald Percy Bell ...
    Collections series Chemistry and Material Science (R0)
    The suggestion that quantum-mechanical tunnelling might be a significant factor in some chemical reactions was first made fifty years ago by Hund, very soon after the principles of wave mechanics had been established by de Broglie, Schrodinger and Heisenberg, and similar ideas were put forward during the following thirty years by a number of authors. It was realised from the beginning that such ... En savoir plus

    $70.99 CAD

  • Stochasticity in Processes

    Fundamentals and Applications to Chemistry and Biology

    par Peter Schuster ...
    Collections series Physics and Astronomy (R0)
    This book has developed over the past fifteen years from a modern course on stochastic chemical kinetics for graduate students in physics, chemistry and biology. The first part presents a systematic collection of the mathematical background material needed to understand probability, statistics, and stochastic processes as a prerequisite for the increasingly challenging practical applications in ... En savoir plus

    $128.99 CAD

  • Hyperspherical Harmonics And Their Physical Applications

    par James Emil Avery, John Scales Avery ...
    Hyperspherical harmonics are extremely useful in nuclear physics and reactive scattering theory. However, their use has been confined to specialists with very strong backgrounds in mathematics. This book aims to change the theory of hyperspherical harmonics from an esoteric field, mastered by specialists, into an easily-used tool with a place in the working kit of all theoretical physicists, ... En savoir plus

    $56.99 CAD

  • Shock Waves Science and Technology Library, Vol. 6

    Detonation Dynamics

    Modifié par F. Zhang ...
    Collections series Physics and Astronomy (R0)
    This book, as a volume of the Shock Wave Science and Technology Reference Library, is primarily concernedwith the fundamental theory of detonation physics in gaseous and condensed phase reactive media.The detonation process involves complex chemical reaction and fluid dynamics, accompanied by intricate effects of heat, light, electricity and magnetism - a contemporary research field that has found ... En savoir plus

    $179.39 CAD

  • Liquid Crystals

    par Ludwig Pohl, D. Demus, G. Pelzl, Heino Finkelmann, Karl Hiltrop, Martin Schadt ...
    Collections series Chemistry and Material Science (R0)
    In 1959, about 1400 compounds forming liquid crystalline phases were known; by 1992, this number had increased to about 50 000. In portable devices like wristwatches, pocket caculators, measuring instruments, and laptop computers the liquid crystal display technology has gained total acceptance and is on the way to encompass the market of colour TV screens. This development makes a volume devoted ... En savoir plus

    $64.09 CAD

  • Non-Relativistic QED Theory of the van der Waals Dispersion Interaction

    par Akbar Salam ...
    Collections series Chemistry and Material Science (R0)
    This book provides details of the calculation of the interaction between two neutral polarizable atoms or molecules using molecular quantum electrodynamics (QED). To better understand the origin of this force, it briefly outlines molecular QED theory, the well-known van der Waals dispersion potential first evaluated by Casimir and Polder, who accounted for retardation effects. It presents ... En savoir plus

    $64.09 CAD

  • Materials and Surface Engineering

    Research and Development

    Modifié par J. Paulo Davim, J Paulo Davim ...
    Collections series Woodhead Publishing Reviews: Mechanical Engineering Series
    This book, the second in the Woodhead Publishing Reviews: Mechanical Engineering Series, is a collection of high quality articles (full research articles, review articles, and cases studies) with a special emphasis on research and development materials and surface engineering and its applications. Surface engineering techniques are being used in the automotive, aircraft, aerospace, missile, ... En savoir plus

    $203.99 CAD