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Books in Atomic and molecular structure

  • Molecular Orbital Theory and Frontier Orbitals for Organic Chemistry

    A Practical Guide
    • 1st Edition
    • October 17, 2025
    • Dipak Kumar Mandal
    • English
    Molecular Orbital Theory and Frontier Orbitals for Organic Chemistry: A Practical Guide is a crucial text for students of organic chemistry. This book provides simple, yet quantifiable explanations based on molecular orbital-based reasoning. It seeks to deepen the reader's understanding of long-standing concepts in MO theory, while also formulating new ones through perturbation molecular orbital theory. Written for undergraduates, graduates, and researchers, the book includes many problems with detailed solutions, allowing readers to test their knowledge as they progress through each chapter.The book emphasizes a practical and pedagogical approach, perfected through the authors' extensive teaching experience. It is ideal for those wishing to gain a thorough understanding of molecular orbital theory, from students to seasoned chemists. The text aims to be distinct in its methodology, making it accessible to a wide audience. The inclusion of in-chapter problems helps reinforce learning, ensuring that readers can immediately apply what they have learned. This book serves as an indispensable resource for anyone seeking to master this fundamental aspect of organic chemistry.

  • Theoretical and Physical Chemistry of Triel Bonding

    Properties, Mechanisms, and Catalysis
    • 1st Edition
    • Volume 24
    • September 18, 2025
    • Sławomir Janusz Grabowski
    • English
    Theoretical and Physical Chemistry of Triel Bonding: Properties, Mechanisms, and Catalysis explores triel and their compounds, providing a detailed analysis of their molecular and electronic structures, areas often disputed and controversial. It offers a comprehensive description and explanation, emphasizing the unique differences between boron and heavier triel atoms. Key sections cover theoretical foundations, types of interactions, and examples of triel bonds and their characteristics. Additionally, the book highlights triel elements functioning as catalysts and boron compounds in hydrogen storage. Designed for advanced students and researchers in physical or theoretical/computat... chemistry, it will also interest organic and inorganic chemists.Compounds of boron and other triel centres have been the subject of numerous studies for a long time, with their properties well-known and frequently discussed. However, the more detailed characteristics of triel compounds have not been well analyzed in existing research and their molecular and electronic structures have often been the subject of dispute and controversy. Triel bonds as a thematic area have garnered significant interest in recent years and this book provides a much broader description and explanation of their properties and characteristics than has previously been available, discussing aspects which are unique to triel bonds such as the differences between boron and the heavier triel atoms.

  • Nanochemistry

    Chemistry of Nanoparticle Formation and Interactions
    • 1st Edition
    • August 4, 2023
    • Anna Klinkova + 1 more
    • English
    Nanochemistry: Chemistry of Nanoparticle Formation and Interactions provides an overview of the chemistry aspects of nanoparticle science, including nanoparticle synthesis, chemical properties, stability, applications and self-assembly behavior. The critical concepts discussed in this book represent the necessary toolbox for enabling the rational design of nanoparticle-based materials for target applications. After an introduction to standard analytical techniques used for nanoparticle characterization, four separate chapters cover inorganic, organic, polymer nanoparticles, and carbon nanostructures to highlight the synthetic protocols, structural intricacies, and chemical properties specific to each of these material classes. Finally, physicochemical phenomena governing self-assembly behavior of nanoparticles are also discussed in detail separately. This book is intended for senior undergraduate, graduate and postgraduate students and research scientists in nanoscience and nanotechnology, material science, chemistry, physics, biomedical sciences and relevant engineering fields that want to develop a deeper understanding of the governing chemical principles on the nanoscale.

  • Hot Topics in Crystal Engineering

    • 1st Edition
    • August 24, 2021
    • Kari Rissanen
    • English
    Hot Topics in Crystal Engineering covers the design and synthesis of single crystalline solid-state materials, their properties and applications, focusing on the understanding and use of intermolecular interactions that constitute single crystalline materials. Many of the most modern materials, such as metal-organic frameworks (MOFs) capable of gas storage and separation, and selective entrapment of harmful substances, are the result of the rational use of crystal engineering. Topics covered in this work highlight breakthroughs in this rapidly developing field. This work offers a carefully chosen cross-section of the latest developments, some in their early infancy and some covered for the first time.

  • NMR of Paramagnetic Molecules

    Applications to Metallobiomolecules and Models
    • 2nd Edition
    • Volume 2
    • September 15, 2016
    • Ivano Bertini + 3 more
    • English
    NMR of Paramagnetic Molecules: Applications to Metallobiomolecules and Models, Second Edition is a self-contained, comprehensive reference for chemists, physicists, and life scientists whose research involves analyzing paramagnetic compounds. Since the previous edition of this book was published, there have been many advancements in the field of paramagnetic NMR spectroscopy. This completely updated and expanded edition contains the latest fundamental theory and methods for mastery of this analytical technique. Users will learn how to interpret the NMR spectra of paramagnetic molecules, improve experimental techniques, and strengthen their understanding of the underlying theory and applications.

  • Sulfur

    Its Significance for Chemistry, for the Geo-, Bio-, and Cosmosphere and Technology
    • 1st Edition
    • Volume 5
    • January 26, 2016
    • A. Müller + 1 more
    • English
    Sulfur: Its Significance for Chemistry, for the Geo-, Bio- and Cosmosphere and Technology focuses on the significance of sulfur for chemistry, geosphere, biosphere, cosmosphere, and technology. Topics covered range from the geochemistry and natural cycle of sulfur to the role of sulfur in "black powder". Organometallic sulfur compounds, thiolates, and the spectroscopic effects of sulfur chemistry are also discussed. Comprised of 21 chapters, this volume begins with an introduction to elemental sulfur and related homocyclic compounds and ions, focusing on their preparation, molecular and crystal structures, molecular spectra, and thermodynamic properties. Subsequent chapters deal with the origin and natural cycle of sulfur in the earth's crust; the role of sulfur in the reactions of exploding gunpowder; the use of sulfur in artwork; and developments in the field of organic sulfur chemistry. The catalytic properties of metal complexes of sulfur and sulfur-nitrogen compounds are also examined, along with the synthetic aspects of sulfido-complexes of molybdenum and tungsten. The final section is devoted to the role of sulfur in microbiology, biochemistry, and medicine. This monograph will be useful to students, practitioners, and researchers in the field of inorganic chemistry, as well as those who are interested in sulfur and its compounds.

  • Principles and Applications of Quantum Chemistry

    • 1st Edition
    • October 15, 2015
    • V.P. Gupta
    • English
    Principles and Applications of Quantum Chemistry offers clear and simple coverage based on the author’s extensive teaching at advanced universities around the globe. Where needed, derivations are detailed in an easy-to-follow manner so that you will understand the physical and mathematical aspects of quantum chemistry and molecular electronic structure. Building on this foundation, this book then explores applications, using illustrative examples to demonstrate the use of quantum chemical tools in research problems. Each chapter also uses innovative problems and bibliographic references to guide you, and throughout the book chapters cover important advances in the field including: Density functional theory (DFT) and time-dependent DFT (TD-DFT), characterization of chemical reactions, prediction of molecular geometry, molecular electrostatic potential, and quantum theory of atoms in molecules.

  • Proceedings of MEST 2012: Electronic Structure Methods with Applications to Experimental Chemistry

    • 1st Edition
    • Volume 68
    • January 3, 2014
    • Philip E. Hoggan
    • English
    Advances in Quantum Chemistry presents surveys of current topics in this rapidly developing field that has emerged at the cross section of the historically established areas of mathematics, physics, chemistry, and biology. It features detailed reviews written by leading international researchers. This volume focuses on the theory of heavy ion physics in medicine.

  • Structure of Matter

    With Contributions in Memoriam Including a Complete Bibliography of His Works
    • 1st Edition
    • October 22, 2013
    • C. Guy Suits
    • English
    The Collected Works of Irving Langmuir: Volume 6, Structure of Matter deals with the research work of Irving Langmuir in the field of thermionics, gaseous discharge, and on the structure of atoms with emphasis on valence. Some of the paper he writes on the subject of atomic structure are: "The Structure of Atoms and the Octet Theory of Valence," "The Arrangement of Electrons in Atoms and Molecules," and "The Octet Theory of Valence and its Applications with Special Reference to Organic Nitrogen Compounds." He challenges the complexities of valence theory and atomic structure, leading to a complete change of the theoretical structure of the subject of chemistry. Langmuir also works on molecules and crystalline structures, and applies the structures of crystals to check and confirm his own theories on molecular structure. His assumption that "the force between molecules in contact can be considered as caused by a surface energy proportional to the area over which the molecules are in contact" provides a solid foundation for explaining the properties of many chemical substances. Chemists, students, academicians, scientists, and general readers interested in the lives of great men in science will find this book very informative.

  • Inorganic Polymeric Glasses

    • 1st Edition
    • Volume 15
    • October 22, 2013
    • Richard C. Ropp
    • English
    The author describes a novel method of preparing hydrolysis-stable non-silicate glasses which is based on experimental work accomplished over the past twenty years. As such, the method is the beginning of a new approach to glass-making by the use of a molecularly-polymeri... precursor. The book elucidates the technical details required to produce such molecularly-polymeri... glasses from carefully prepared inorganic molecular monomers. Essentially, only silicate-based glasses have been known to be stable, whereas non-silicate glasses could not be attributed with such properties. Such glasses have, therefore, not found widespread usage in industry. The new phosphate glasses described here exhibit stabilities superior to many of the silicate glasses. For example, the nuclear-waste glass shows no measurable loss at all in boiling water, something entirely foreign to the zinc borosilicate glasses developed for nuclear waste encapsulation in the U.S. by Battelle-Northwest. The exceptional stability of the new glasses is achieved by selecting an inorganic compound capable of being polymerized, and then causing it to polymerize in a proper manner, in the absence of chain-stoppers. To obtain glasses equal or superior in hydrolysis stability to silicate-based systems it is imperative to employ molecular polymerization in situ, starting from carefully prepared precursors of exact stoichiometric proportion. Researchers in glass and glass properties will find this volume extremely useful and those involved in organic polymers will be intrigued by the similarities and disparities of the two systems.