Download or read book The HMO Model and Its Application Basis and manipulation written by Edgar Heilbronner and published by . This book was released on 1976 with total page pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book The HMO model and its application written by Edgar Heilbronner and published by Wiley-VCH. This book was released on 1976 with total page 454 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book The HMO Model and Its Application written by Edgar Heilbronner and published by . This book was released on 1976 with total page 454 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Computational Methods in Quantum Chemistry written by Ahmed A. Hasanein and published by World Scientific. This book was released on 1996 with total page 264 pages. Available in PDF, EPUB and Kindle. Book excerpt: An account, from first principles, of the methods of numerical quantum mechanics. Coverage encompasses formulations and fundamental postulates; the Hamiltonian and angular momentum operators; and approximation of the solutions of the Schroedinger equation
Download or read book The HMO Model and Its Application written by Edgar Heilbronner and published by Wiley-VCH. This book was released on 1976 with total page 206 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Computational Chemistry written by Errol G. Lewars and published by Springer Science & Business Media. This book was released on 2010-11-10 with total page 675 pages. Available in PDF, EPUB and Kindle. Book excerpt: This corrected second edition contains new material which includes solvent effects, the treatment of singlet diradicals, and the fundamentals of computaional chemistry. "Computational Chemistry: Introduction to the Theory and Applications of Molecular and Quantum Mechanics" is an invaluable tool for teaching and researchers alike. The book provides an overview of the field, explains the basic underlying theory at a meaningful level that is not beyond beginners, and it gives numerous comparisons of different methods with one another and with experiment. The following concepts are illustrated and their possibilities and limitations are given: - potential energy surfaces; - simple and extended Hueckel methods; - ab initio, AM1 and related semiempirical methods; - density functional theory (DFT). Topics are placed in a historical context, adding interest to them and removing much of their apparently arbitrary aspect. The large number of references, to all significant topics mentioned, should make this book useful not only to undergraduates but also to graduate students and academic and industrial researchers.
Download or read book The HMO Model and Its Application Problems with solutions written by Edgar Heilbronner and published by . This book was released on 1976 with total page 504 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Quantum Chemistry Aided Design Of Organic Polymers An Introduction To The Quantum Chemistry Of Polymers And Its Applications written by Jean-marie Andre and published by World Scientific. This book was released on 1991-01-25 with total page 391 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book is intended for those who are interested in understanding the electronic structure and properties of polymers. The scope of the book is to provide the non-specialist reader with a comprehensive and unified description: (i) of quantum mechanical methods, mainly originating from quantum chemistry, to calculate the electronic properties of polymers, (ii) of their use for interpreting and predicting results in fields where the electronic structure is playing an important role, like the electrical conductivity and the non linear optical properties of conjugated polymers.It will also serve as a reference book to lecture graduate students on the electronic structure of polymers or more generally of quasi-one dimensional materials. In this framework, it is worth stressing that the quantum theory of polymers bridges the gap between chemistry and physics. Since no book of this kind involving a strong interaction between theoretical and experimental concepts is available at the moment, it will also meet a need for a timely monograph in a field of important and fast growing interest.
Download or read book The Chemistry of Peroxides Volume 3 written by and published by John Wiley & Sons. This book was released on 2015-04-20 with total page 957 pages. Available in PDF, EPUB and Kindle. Book excerpt: The understanding of functional groups is key for the understanding of all organic chemistry. In the tradition of the Patai Series each volume treats all aspects of functional groups. Each volume contains chapters on the theoretical and physicochemical foundations; on analytical aspects; on reaction mechanisms; on applications in synthesis. Depending on the functional group there are additional chapters on industrial use, on medical use, and on human and environmental toxicity issues. The last volume in the series on the topic (Peroxides Vol. 2) was published in 2006. In the eight years since then a lot of developments have taken place, especially in the areas of synthesis, analysis and a better theoretical understanding of the reaction mechanism, all of which are covered here. As with all new volumes, the chapters are first published online in Patai's Chemistry of Functional Groups. Once a volume is completed online, it is then published in print format. The printed book offers the traditional quality of the Patai Book Series, complete with an extensive index.
Download or read book Organic Chemistry written by Pierre Vogel and published by John Wiley & Sons. This book was released on 2019-07-30 with total page 1382 pages. Available in PDF, EPUB and Kindle. Book excerpt: The know-how about reactivity, reaction mechanisms, thermodynamics and other basics in physical organic chemistry is the key for successful organic reactions. This textbook presents comprehensively this knowledge to the student and to the researcher, too. Includes Q&As.
Download or read book Exploring Aspects of Computational Chemistry written by Jean-Marie André and published by Presses universitaires de Namur. This book was released on 1997 with total page 262 pages. Available in PDF, EPUB and Kindle. Book excerpt: Pris ensemble, les deux volumes offrent une introduction théorique et pratique à la chimie quantique statistique. Ce livre s'adresse à un public spécialisé : étudiants de licence, doctorants, chercheurs...
Download or read book Computational Modeling of Polymers written by Jozef Bicerano and published by CRC Press. This book was released on 1992-03-17 with total page 672 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Molecular Design written by A.L. Horvath and published by Elsevier. This book was released on 2012-12-02 with total page 1505 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book is a systematic presentation of the methods that have been developed for the interpretation of molecular modeling to the design of new chemicals. The main feature of the compilation is the co-ordination of the various scientific disciplines required for the generation of new compounds. The five chapters deal with such areas as structure and properties of organic compounds, relationships between structure and properties, and models for structure generation. The subject is covered in sufficient depth to provide readers with the necessary background to understand the modeling techniques. The book will be of value to chemists in industries involved in the manufacture of organic chemicals such as solvents refrigerants, blood substitutes, etc. It also serves as a reference work for researchers, academics, consultants, and students interested in molecular design.
Download or read book The HMO Model and Its Application written by and published by . This book was released on 1976 with total page pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book The HMO Model and Its Application written by Edgar Heilbronner and published by . This book was released on 1976 with total page pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book On Quanta Mind and Matter written by Harald Atmanspacher and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 394 pages. Available in PDF, EPUB and Kindle. Book excerpt: INSTEAD OF A "FESTSCHRIFT" In June 1998 Hans Primas turned 70 years old. Although he himself is not fond of jubilees and although he likes to play the decimal system of numbers down as contingent, this is nevertheless a suitable occasion to reflect on the professional work of one of the rare distinguished contempo rary scientists who attach equal importance to experimental and theoretical and conceptual lines of research. Hans Primas' interests have covered an enormous range: methods and instruments for nuclear magnetic resonance, theoretical chemistry, C* - and W* -algebraic formulations of quantum me chanics, the measurement problem and its various implications, holism and realism in quantum theory, theory reduction, the work and personality of Wolfgang Pauli, as well as Jungian psychology. In many of these fields he provided important and original food for thought, in some cases going far beyond the everyday business in the scien tific world. As is the case with other scientists who are conceptually inno vative, Hans Primas is read more than he is quoted. His influence is due to his writings. Even with the current flood of publications, he still performs the miracle of having scientists eagerly awaiting his next publication.
Download or read book Chemical Graph Theory written by D Bonchev and published by Routledge. This book was released on 2018-05-11 with total page 310 pages. Available in PDF, EPUB and Kindle. Book excerpt: This volume presents the fundamentals of graph theory and then goes on to discuss specific chemical applications. Chapter 1 provides a historical setting for the current upsurge of interest in chemical graph theory. Chapter 2 gives a full background of the basic ideas and mathematical formalism of graph theory and includes such chemically relevant notions as connectedness, graph matrix representations, metric properties, symmetry and operations on graphs. This is followed by a discussion on chemical nomenclature and the trends in its rationalization by using graph theory, which has important implications for the storage and retrieval of chemical information. This volume also contains a detailed discussion of the relevance of graph-theoretical polynomials; it describes methodologies for the enumeration of isomers, incorporating the classical Polya method, as well as more recent approaches.
