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  • Computational Materials Science

    Series Book 15 - Theoretical and Computational Chemistry
    Computational tools have been permanently deposited into the toolbox of theoretical chemists. The impact of new computational tools can hardly be overestimated, and their presence in research and applications is overwhelming. Theoretical methods such as quantum mechanics, molecular dynamics, and statistical mechanics have been successfully used to characterize chemical systems and to design new ... Read more

    $282.39 CAD

  • Emerging Materials and Environment

    Series series Chemistry and Material Science (R0)
    This contributed volume presents chapters integrating experimental and computational advances in materials research and discusses how the potential release of emerging materials would impact the environment. With increasing populations, there is a growing pressure on resources and the environment to provide food, water, and energy. Innovative materials and novel technologies, such as nanocomposite ... Read more

    $218.99 CAD

  • Current Trends in Computational Modeling for Drug Discovery

    Series series Chemistry and Material Science (R0)
    This contributed volume offers a comprehensive discussion on how to design and discover pharmaceuticals using computational modeling techniques. The different chapters deal with the classical and most advanced techniques, theories, protocols, databases, and tools employed in computer-aided drug design (CADD) covering diverse therapeutic classes. Multiple components of Structure-Based Drug ... Read more

    $307.99 CAD

  • Development of Solar Cells

    Theory and Experiment

    Series series Chemistry and Material Science (R0)
    This book presents a comprehensive overview of the fundamental concept, design, working protocols, and diverse photo-chemicals aspects of different solar cell systems with promising prospects, using computational and experimental techniques. It presents and demonstrates the art of designing and developing various solar cell systems through practical examples. Compared to most existing books in the ... Read more

    $218.99 CAD

  • Practical Aspects of Computational Chemistry V

    Series series Chemistry and Material Science (R0)
    This book presents contributions on a wide range of computational research applied to fields ranging from molecular systems to bulk structures. This volume highlights current trends in modern computational chemistry and discusses the development of theoretical methodologies, state-of-the-art computational algorithms and their practical applications. This volume is part of a continuous effort by ... Read more

    $218.99 CAD

  • Energetic Materials

    From Cradle to Grave

    Series series Chemistry and Material Science (R0)
    This book offers a comprehensive account of energetic materials, including their synthesis, computational modeling, applications, associated degradation mechanisms, environmental consequences and fate and transport. This multi-author contributed volume describes how armed forces around the world are moving their attention from legacy explosive compounds, which are heat and shock sensitive (thus ... Read more

    $499.99 CAD

  • Practical Aspects of Computational Chemistry

    Methods, Concepts and Applications

    Series series Chemistry and Material Science (R0)
    "Practical Aspects of Computational Chemistry" presents contributions on a range of aspects of Computational Chemistry applied to a variety of research fields. The chapters focus on recent theoretical developments which have been used to investigate structures and properties of large systems with minimal computational resources. Studies include those in the gas phase, various solvents, various ... Read more

    $179.99 CAD

  • Practical Aspects of Computational Chemistry III

    Series series Chemistry and Material Science (R0)
    Theoretical and Computational Chemistry research has made unparalleled advancements in understanding every expanding area of science and technology. This volume presents the state-of-the-art research and progress made by eminent researchers in the area of theoretical computational chemistry and physics. The title mirrors the name of the annual international conference “Conference on Current Trends ... Read more

    $115.99 CAD

  • Practical Aspects of Computational Chemistry IV

    Series series Chemistry and Material Science (R0)
    The editors of this volume have compiled an important book that is a useful vehicle for important computational research - in the development of theoretical methodologies and their practical applications. Themes include new methodologies, state-of-the-art computational algorithms and hardware as well as new applications. This volume, Practical Aspects of Computational Chemistry IV, is part of a ... Read more

    $115.99 CAD

  • Linear-Scaling Techniques in Computational Chemistry and Physics

    Methods and Applications

    Series series Chemistry and Material Science (R0)
    "Linear-Scaling Techniques in Computational Chemistry and Physics" summarizes recent progresses in linear-scaling techniques and their applications in chemistry and physics. In order to meet the needs of a broad community of chemists and physicists, the book focuses on recent advances that extended the scope of possible exploitations of the theory.The first chapter provides an overview of the ... Read more

    $409.99 CAD

  • Practical Aspects of Computational Chemistry I

    An Overview of the Last Two Decades and Current Trends

    Series series Chemistry and Material Science (R0)
    Practical Aspects of Computational Chemistry I: An Overview of the Last Two Decades and Current Trends gathers the advances made within the last 20 years by well-known experts in the area of theoretical and computational chemistry and physics. The title itself reflects the celebration of the twentieth anniversary of the “Conference on Current Trends in Computational Chemistry (CCTCC)” to which all ... Read more

    $256.99 CAD