Quantum Chemistry

Author: Ira N. Levine

Publisher: Allyn & Bacon

ISBN: N.A

Category: Quantum chemistry

Page: 629

View: 6361

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An introduction to quantum chemistry which covers quantum mechanics, atomic structure and molecular electronic structure. All the necessary mathematics is presented alongside the physics and chemistry, and is given sufficient detail to be accessible to those with little mathematical background.
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Elementary Quantum Chemistry, Second Edition

Author: Frank L. Pilar

Publisher: Courier Corporation

ISBN: 0486143872

Category: Science

Page: 640

View: 5688

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Useful introductory course and reference covers origins of quantum theory, Schrödinger wave equation, quantum mechanics of simple systems, electron spin, quantum states of atoms, Hartree-Fock self-consistent field method, more. 1990 edition.
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Quantum Chemistry Student Edition

Author: John Lowe

Publisher: Elsevier

ISBN: 0323144438

Category: Science

Page: 618

View: 9358

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Quantum Chemistry: Student Edition emphasizes the ground state molecular orbital theory of molecules. This book contains 14 chapters that also cover some aspects of quantum mechanics theory. The opening chapters deal with some simple, but important, particle systems, allowing the introduction of many basic concepts and definitions of classical physics. The subsequent chapters consider the simple harmonic oscillator, the hydrogenlike ion, and many-electron atoms. Considerable chapters are devoted to the development of methods for performing linear variational calculations. These methods require solving a determinantal equation for its roots, and then solving a set of simultaneous homogeneous equations for coefficients. The closing chapters explore the concept and application of group theory and the qualitative molecular orbital theory. This book is of great value to organic, inorganic, and physical chemists, as well as to undergraduate or graduate chemistry students.
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Issues in Specialized Chemical and Chemistry Topics: 2013 Edition

Author: N.A

Publisher: ScholarlyEditions

ISBN: 1490110801

Category: Science

Page: 1228

View: 3260

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Issues in Specialized Chemical and Chemistry Topics: 2013 Edition is a ScholarlyEditions™ book that delivers timely, authoritative, and comprehensive information about Magnetic Resonance. The editors have built Issues in Specialized Chemical and Chemistry Topics: 2013 Edition on the vast information databases of ScholarlyNews.™ You can expect the information about Magnetic Resonance in this book to be deeper than what you can access anywhere else, as well as consistently reliable, authoritative, informed, and relevant. The content of Issues in Specialized Chemical and Chemistry Topics: 2013 Edition has been produced by the world’s leading scientists, engineers, analysts, research institutions, and companies. All of the content is from peer-reviewed sources, and all of it is written, assembled, and edited by the editors at ScholarlyEditions™ and available exclusively from us. You now have a source you can cite with authority, confidence, and credibility. More information is available at http://www.ScholarlyEditions.com/.
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Principles and Applications of Quantum Chemistry

Author: V.P. Gupta

Publisher: Academic Press

ISBN: 0128035013

Category: Science

Page: 478

View: 3422

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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. Simplified mathematical content and derivations for reader understanding Useful overview of advances in the field such as Density Functional Theory (DFT) and Time-Dependent DFT (TD-DFT) Accessible level for students and researchers interested in the use of quantum chemistry tools
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Issues in Chemistry and General Chemical Research: 2011 Edition

Author: N.A

Publisher: ScholarlyEditions

ISBN: 1464963290

Category: Science

Page: 6580

View: 6588

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Issues in Chemistry and General Chemical Research: 2011 Edition is a ScholarlyEditions™ eBook that delivers timely, authoritative, and comprehensive information about Chemistry and General Chemical Research. The editors have built Issues in Chemistry and General Chemical Research: 2011 Edition on the vast information databases of ScholarlyNews.™ You can expect the information about Chemistry and General Chemical Research in this eBook to be deeper than what you can access anywhere else, as well as consistently reliable, authoritative, informed, and relevant. The content of Issues in Chemistry and General Chemical Research: 2011 Edition has been produced by the world’s leading scientists, engineers, analysts, research institutions, and companies. All of the content is from peer-reviewed sources, and all of it is written, assembled, and edited by the editors at ScholarlyEditions™ and available exclusively from us. You now have a source you can cite with authority, confidence, and credibility. More information is available at http://www.ScholarlyEditions.com/.
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Issues in General Science and Scientific Theory and Method: 2011 Edition

Author: N.A

Publisher: ScholarlyEditions

ISBN: 1464963479

Category: Science

Page: 3278

View: 8708

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Issues in General Science and Scientific Theory and Method: 2011 Edition is a ScholarlyEditions™ eBook that delivers timely, authoritative, and comprehensive information about General Science and Scientific Theory and Method. The editors have built Issues in General Science and Scientific Theory and Method: 2011 Edition on the vast information databases of ScholarlyNews.™ You can expect the information about General Science and Scientific Theory and Method in this eBook to be deeper than what you can access anywhere else, as well as consistently reliable, authoritative, informed, and relevant. The content of Issues in General Science and Scientific Theory and Method: 2011 Edition has been produced by the world’s leading scientists, engineers, analysts, research institutions, and companies. All of the content is from peer-reviewed sources, and all of it is written, assembled, and edited by the editors at ScholarlyEditions™ and available exclusively from us. You now have a source you can cite with authority, confidence, and credibility. More information is available at http://www.ScholarlyEditions.com/.
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Perspectives in Quantum Chemistry

Plenary Lectures Presented at the Sixth International Congress on Quantum Chemistry Held in Jerusalem, Israel, August 22–25 1988

Author: Joshua Jortner,A. Pullman

Publisher: Springer

ISBN: 9789401069175

Category: Science

Page: 180

View: 9878

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The Sixth International Congress on Quantum Chemistry convened at the Campus of the Hebrew University. Jerusalem. Israel. on August 22-25. 1988. The International Congresses on Quantum Chemistry are held under the auspices of the International Academy of Quantum Molecular Science. Previous International Congresses on Quantum Chemistry were held in France. Japan, the United States, Sweden and Canada. These prestigious meetings provided a central contribution to the important modern area of theoretical chemistry. The major goals of the Sixth International Congress on Quantum Chemistry were: A) To provide an overview of recent novel developments. advances and directions of research in the broad area of quantum molecular sciences. B) To establish strong interaction between the theoretical discipline of quantum molecular sciences and experiment. The general topics of the Sixth International Congress were: a) Molecular Quantum Mechanics b) Many-Body Theory of Molecular Structure c) Intermolecular Forces d) Complexes and Clusters e) Molecular Spectroscopy f) Intramolecular Dynamics g) Chemical Reactions h) Molecular Dynamics Simulations i) Condensed-Phase Chemistry j) Surface Phenomena and Catalysis k) Quantum Biochemistry 1) Biophysics The format of the Sixth International Congress consisted of plenary lectures. symposia and poster sessions. In the opening session of the Congress. commemorative addresses were delivered in honoured memory of the late Louis de Broglie and the late Robert S. Mulliken. Nobel Prize Laureates and Members of the International Academy of Quantum Molecular Science. A com memorative symposium was devoted to the honoured memory of the late Massimo Simonetta.
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Physical Chemistry, Volume 2

Quantum Chemistry, Spectroscopy, and Statistical Thermodynamics

Author: Peter Atkins,Julio de Paula

Publisher: W. H. Freeman

ISBN: 9781464124525

Category: Science

Page: 464

View: 7890

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Edition after edition, Atkins and de Paula's #1 bestseller remains the most contemporary, most effective full-length textbook for courses covering thermodynamics in the first semester and quantum mechanics in the second semester. Its molecular view of physical chemistry, contemporary applications, student friendly pedagogy, and strong problem-solving emphasis make it particularly well-suited for pre-meds, engineers, physics, and chemistry students. Now organized into briefer, more manageable topics, and featuring additional applications and mathematical guidance, the new edition helps students learn more effectively, while allowing instructors to teach the way they want. Available in Split Volumes For maximum flexibility in your physical chemistry course, this text is now offered as a traditional text or in two volumes: Volume 1: Thermodynamics and Kinetics: 1-4641-2451-5 Volume 2: Quantum Chemistry: 1-4641-2452-3
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“The” Conceptual Completion and the Extensions of Quantum Mechanics 1932 - 1941 ; Epilogue: Aspects of the Further Development of Quantum Theory 1942 - 1999

6, The completion of quantum mechanics 1926 - 1941Pt. 2

Author: Jagdish Mehra,Helmut Rechenberg

Publisher: Springer Science & Business Media

ISBN: 9780387951829

Category: Computers

Page: 1614

View: 4325

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Quantum Theory, together with the principles of special and general relativity, constitute a scientific revolution that has profoundly influenced the way in which we think about the universe and the fundamental forces that govern it. The Historical Development of Quantum Theory is a definitive historical study of that scientific work and the human struggles that accompanied it from the beginning. Drawing upon such materials as the resources of the Archives for the History of Quantum Physics, the Niels Bohr Archives, and the archives and scientific correspondence of the principal quantum physicists, as well as Jagdish Mehra's personal discussions over many years with most of the architects of quantum theory, the authors have written a rigorous scientific history of quantum theory in a deeply human context. This multivolume work presents a rich account of an intellectual triumph: a unique analysis of the creative scientific process. The Historical Development of Quantum Theory is science, history, and biography, all wrapped in the story of a great human enterprise. Its lessons will be an aid to those working in the sciences and humanities alike.||Comments by distinguished physicists on "The Historical Development of Quantum Theory":||"¿the most definitive work undertaken by anyone on this vast and most important development in the history of physics. Jagdish Mehra, trained in theoretical physics under Pauli, Heisenberg, and Dirac, pursued the vision of his youth to write about the historical and conceptual development of quantum theory in the 20th century¿This series of books on the HDQT has thus become the most authentic and permanent source of our knowledge of how quantum theory, its extensions and applications developed. My heartfelt congratulations."|-Hans A. Bethe, Nobel Laureate||"A thrilling and magnificent achievement!"|-Subrahmanyan Chandrasekhar, FRS, Nobel Laureate||"¿capture(s) precisely, accurately, and thoroughly the very essence and all the fundamental details of the theory, and that is a remarkable achievement¿I have greatly enjoyed reading these books and learned so many new things from them. This series of books will remain a permanent source of knowledge about the creation and development of quantum theory. Congratulations!"|-Paul A. Dirac, FRS, Nobel Laureate||"The wealth and accuracy of detail in 'The Historical Development of Quantum Theory' are breathtaking."|-Richard P. Feynman, Nobel Laureate
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