Quantum Chemistry

Author: David B Cook
Editor: World Scientific Publishing Company
ISBN: 1911299581
File Size: 47,69 MB
Format: PDF
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This book is a presentation of a qualitative theory of chemical bonding, stressing the physical processes which occur on bond formation. It differs from most (if not all) other books in that it does not seek to “rationalise” the phenomena of bonding by a series of mnemonic rules. A principal feature is a unified and consistent treatment across all types of bonding in organic, inorganic, and physical chemistry. Each chapter has an Assignment Section containing “problems” which might be usefully attempted to improve the understanding of the new material in that chapter. The new edition has had several appendices added which give support to concepts which, if included in the main text, would have hindered the main thrust of the presentation. These new appendices are an attempt to clarify oversights and errors which have been tacitly ignored and which have now become part of the conventional wisdom.

Quantum Mechanics

Author: Fayyazuddin
Editor: World Scientific Publishing Company
ISBN: 9814412929
File Size: 67,32 MB
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This book provides a comprehensive account of basic concepts of quantum mechanics in a coherent manner. The book is self-contained and not only covers basic concepts in quantum mechanics but also provides a basis for applications in atomic and laser physics, nuclear and particle physics, and condensed matter physics. It also covers relativistic quantum mechanics, in particular the Dirac equation and its applications.

Quantum Chemistry

Author: Ajit Thakkar
Editor: Morgan & Claypool Publishers
ISBN: 1681746387
File Size: 27,55 MB
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This book provides non-specialists with a basic understanding ofthe underlying concepts of quantum chemistry. It is both a text for second or third-year undergraduates and a reference for researchers who need a quick introduction or refresher. All chemists and many biochemists, materials scientists, engineers, and physicists routinely user spectroscopic measurements and electronic structure computations in their work. The emphasis of Quantum Chemistry on explaining ideas rather than enumerating facts or presenting procedural details makes this an excellent foundation text/reference. The keystone is laid in the first two chapters which deal with molecular symmetry and the postulates of quantum mechanics, respectively. Symmetry is woven through the narrative of the next three chapters dealing with simple models of translational, rotational, and vibrational motion that underlie molecular spectroscopy and statistical thermodynamics. The next two chapters deal with the electronic structure of the hydrogen atom and hydrogen molecule ion, respectively. Having been armed with a basic knowledge of these prototypical systems, the reader is ready to learn, in the next chapter, the fundamental ideas used to deal with the complexities of many-electron atoms and molecules. These somewhat abstract ideas are illustrated with the venerable Huckel model of planar hydrocarbons in the penultimate chapter. The book concludes with an explanation of the bare minimum of technical choices that must be made to do meaningful electronic structure computations using quantum chemistry software packages.

Student Problems And Solutions Manual For Quantum Chemistry 2e

Author: Mark Marshall
Editor: University Science Books
ISBN: 9781891389528
File Size: 65,97 MB
Format: PDF, Mobi
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The detailed solutions manual accompanies the second edition of McQuarrie's Quantum Chemistry.

Exam Prep For Introduction To Quantum Mechanics 2nd Edition

Author:
Editor:
ISBN:
File Size: 70,95 MB
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Elementary Quantum Chemistry Second Edition

Author: Frank L. Pilar
Editor: Courier Corporation
ISBN: 0486143872
File Size: 31,16 MB
Format: PDF, Docs
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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.

Quantum Chemistry

Author: R.K. Prasad
Editor: New Age International
ISBN: 9788122412642
File Size: 60,16 MB
Format: PDF, Docs
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Quantum Mechanics Second Edition

Author: Paul C.W. Davies
Editor: CRC Press
ISBN: 9780748744466
File Size: 30,25 MB
Format: PDF, Mobi
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Quantum mechanics is the key to modern physics and chemistry, yet it is notoriously difficult to understand. This book is designed to overcome that obstacle. Clear and concise, it provides an easily readable introduction intended for science undergraduates with no previous knowledge of quantum theory, leading them through to the advanced topics usually encountered at the final year level. Although the subject matter is standard, novel techniques have been employed that considerably simplify the technical presentation. The authors use their extensive experience of teaching and popularizing science to explain the many difficult, abstract points of the subject in easily comprehensible language. Helpful examples and thorough sets of exercises are also given to enable students to master the subject.

Quantum Chemistry 2 E

Author: Awode, Mahendra R.
Editor: S. Chand Publishing
ISBN: 9788121920957
File Size: 38,24 MB
Format: PDF
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For B.Sc., M.Sc., B.E. and B.Tech and other Competitve Examinations. Includes 112 solved problems also.

Quantum Chemistry And Spectroscopy

Author: Thomas Engel
Editor: Benjamin-Cummings Publishing Company
ISBN: 9780805338430
File Size: 23,98 MB
Format: PDF, ePub
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Quantum Chemistry and Spectroscopy is a groundbreaking new text that explains core topics in depth with a focus on basic principles, applications, and modern research. The authors hone in on key concepts and cover them thoroughly and in detail - as opposed to the general, encyclopedic approach competing textbooks take. Excessive math formalism is avoided to keep students focused on the most important concepts and to provide greater clarity. Applications woven throughout each chapter demonstrate to students how chemical theories are used to solve real-world chemical problems in biology, environmental science, and material science. Extensive coverage of modern research and new developments in the field get students excited about this dynamic branch of science. This split text (from Physical Chemistry) is organized to facilitate "Quantum first" courses. The online Chemistry Place for Physical Chemistry features interactive problems and simulations that reinforce and build upon material included in the book.

Quantum Chemistry

Author: Donald A. McQuarrie
Editor: University Science Books
ISBN: 9781891389504
File Size: 34,58 MB
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The biggest change in the years since the first edition is the proliferation of computational chemistry programs that calculate molecular properties. McQuarrie presents step-by-step SCF calculations of a helium atom and a hydrogen molecule, in addition to including the Hartree-Fock method and post-Hartree-Fock methods.

Introduction To Quantum Mechanics

Author: S. M. Blinder
Editor: Academic Press
ISBN: 0128223111
File Size: 12,50 MB
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Introduction to Quantum Mechanics, Second Edition presents an accessible, fully-updated introduction on the principles of quantum mechanics. The book outlines the fundamental concepts of quantum theory, discusses how these arose from classic experiments in chemistry and physics, and presents the quantum-mechanical foundations of many key scientific techniques. Chapters cover an introduction to the key principles underpinning quantum mechanics, differing types of molecular structures, bonds and behaviors, and applications of quantum mechanical theory across a number of important fields, including new chapters on Density Functional Theory, Statistical Thermodynamics and Quantum Computing. Drawing on the extensive experience of its expert author, this book is a reliable introduction to the principles of quantum mechanics for anyone new to the field, and a useful refresher on fundamental knowledge and latest developments for anyone more experienced in the field. Presents a fully updated accounting that reflects the most recent developments in Quantum Theory and its applications Includes new chapters on Special Functions, Density Functional Theory, Statistical Thermodynamics and Quantum Computers Presents additional problems and exercises to further support learning

Reviews In Computational Chemistry

Author: Kenny B. Lipkowitz
Editor: John Wiley & Sons
ISBN: 0471458813
File Size: 20,23 MB
Format: PDF, Kindle
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Computational chemistry is increasingly used in most areas ofmolecular science including organic, inorganic, medicinal,biological, physical, and analytical chemistry. Researchers inthese fields who do molecular modelling need to understand and staycurrent with recent developments. This volume, like those prior toit, features chapters by experts in various fields of computationalchemistry. Two chapters focus on molecular docking, one of whichrelates to drug discovery and cheminformatics and the other toproteomics. In addition, this volume contains tutorials onspin-orbit coupling and cellular automata modeling, as well as anextensive bibliography of computational chemistry books. FROM REVIEWS OF THE SERIES "Reviews in Computational Chemistryremains the most valuable reference to methods and techniques incomputational chemistry."—JOURNAL OF MOLECULAR GRAPHICS ANDMODELLING "One cannot generally do better than to try to find anappropriate article in the highly successful Reviews inComputational Chemistry. The basic philosophy of the editors seemsto be to help the authors produce chapters that are complete,accurate, clear, and accessible to experimentalists (in particular)and other nonspecialists (in general)."—JOURNAL OF THEAMERICAN CHEMICAL SOCIETY

Computational Methods In Quantum Chemistry

Author: Ahmed A. Hasanein
Editor: World Scientific
ISBN: 9789810226114
File Size: 63,11 MB
Format: PDF
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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

Physical Chemistry

Author: Peter Atkins
Editor: Oxford University Press, USA
ISBN: 0199609810
File Size: 45,30 MB
Format: PDF
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Physical Chemistry: Quanta, Matter, and Change 2nd edition takes an innovative molecular approach to the teaching of physical chemistry. The distinguished author team presents the subject in a rigorous but accessible manner, allowing students to gain a thorough understanding of physical chemistry.

Quantum Mechanics

Author: G. ARULDHAS
Editor: PHI Learning Pvt. Ltd.
ISBN: 8120336356
File Size: 57,62 MB
Format: PDF, ePub
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The Second Edition of this concise and compact text offers students a thorough understanding of the basic principles of quantum mechanics and their applications to various physical and chemical problems. This thoroughly class-texted material aims to bridge the gap between the books which give highly theoretical treatments and the ones which present only the descriptive accounts of quantum mechanics. Every effort has been made to make the book explanatory, exhaustive and student friendly. The text focuses its attention on problem-solving to accelerate the student’s grasp of the basic concepts and their applications. What is new to this Edition : Includes new chapters on Field Quantization and Chemical Bonding. Provides new sections on Rayleigh Scattering and Raman Scattering. Offers additional worked examples and problems illustrating the various concepts involved. This textbook is designed as a textbook for postgraduate and advanced undergraduate courses in physics and chemistry. Solutions Manual containing the solutions to chapter-end exercises is available for instructors. Solution Manual is available for adopting faculty. Click here to request...

Quantum Chemistry

Author: Ira N. Levine
Editor: Allyn & Bacon
ISBN:
File Size: 25,42 MB
Format: PDF, Mobi
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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.

Introduction To Computational Chemistry

Author: Frank Jensen
Editor: John Wiley & Sons
ISBN: 0470058048
File Size: 65,92 MB
Format: PDF, Mobi
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Introduction to Computational Chemistry, Second Edition provides a comprehensive account of the fundamental principles underlying different methods, ranging from classical to the sophisticated. Although comprehensive in its coverage, this textbook focuses on calculating molecular structures and (relative) energies and less on molecular properties or dynamical aspects. No prior knowledge of concepts specific to computational chemistry are assumed, but the reader will need some understanding of introductory quantum mechanics, linear algebra, and vector, differential and integral calculus.

Introduction To Quantum Mechanics

Author: David J. Griffiths
Editor: Cambridge University Press
ISBN: 1107179866
File Size: 65,84 MB
Format: PDF, ePub, Mobi
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This bestselling textbook teaches students how to do quantum mechanics and provides an insightful discussion of what it actually means.