quantum chemistry and spectroscopy 3rd edition

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Quantum Chemistry And Spectroscopy

Author : Thomas Engel
ISBN : 9780321858283
Genre : Science
File Size : 22. 28 MB
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This is the eBook of the printed book and may not include any media, website access codes, or print supplements that may come packaged with the bound book. Engel and Reid’s Quantum Chemistry & Spectroscopy gives students a¿ contemporary and accurate overview of physical chemistry while focusing on basic principles that unite the sub-disciplines of the field. The Third Edition continues to emphasize fundamental concepts and presents cutting-edge research developments that demonstrate the vibrancy of physical chemistry today.

Quantum Chemistry

Author : Donald A. McQuarrie
ISBN : 1891389505
Genre : Science
File Size : 62. 40 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.

Structure Elucidation In Organic Chemistry

Author : Maria-Magdalena Cid
ISBN : 9783527664634
Genre : Science
File Size : 34. 53 MB
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Intended for advanced readers, this is a review of all relevant techniques for structure analysis in one handy volume. As such, it provides the latest knowledge on spectroscopic and related techniques for chemical structure analysis, such as NMR, optical spectroscopy, mass spectrometry and X-ray crystallography, including the scope and limitation of each method. As a result, readers not only become acquainted with the techniques, but also the advantages of the synergy between them. This enables them to choose the correct analytical method for each problem, saving both time and resources. Special emphasis is placed on NMR and its application to absolute configuration determination and the analysis of molecular interactions. Adopting a practical point of view, the author team from academia and industry guarantees both solid methodology and applications essential for structure determination, equipping experts as well as newcomers with the tools to solve any structural problem.

Proceedings Of 3rd Edition Of International Conference On Advanced Spectroscopy Crystallography And Applications In Modern Chemistry 2018

Author : EuroScicon
ISBN :
Genre : Science
File Size : 38. 41 MB
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June 04-05, 2018 London, UK Key Topics : Chemical Crystallography, Advanced Crystallography, Crystallography Of Novel Materials, Spectroscopy, Spectroscopy Applications, Crystal Growth, Precession Electron Diffraction (PED), Nuclear Magnetic Resonance Crystallography (NMR Crystallography), Electron Crystallography, Recent Development In The X-Ray Studies, Crystallography Applications, Advances In Neutron Diffraction, Biological Structure Determination, Crystallography In Biology, Application Of Modern Chemistry,

Fundamentals Of Quantum Mechanics

Author : J. E. House
ISBN : 9780128092552
Genre : Science
File Size : 27. 75 MB
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Fundamentals of Quantum Mechanics, Third Edition is a clear and detailed introduction to quantum mechanics and its applications in chemistry and physics. All required math is clearly explained, including intermediate steps in derivations, and concise review of the math is included in the text at appropriate points. Most of the elementary quantum mechanical models—including particles in boxes, rigid rotor, harmonic oscillator, barrier penetration, hydrogen atom—are clearly and completely presented. Applications of these models to selected “real world topics are also included. This new edition includes many new topics such as band theory and heat capacity of solids, spectroscopy of molecules and complexes (including applications to ligand field theory), and small molecules of astrophysical interest. Accessible style and colorful illustrations make the content appropriate for professional researchers and students alike Presents results of quantum mechanical calculations that can be performed with readily available software Provides exceptionally clear discussions of spin-orbit coupling and group theory, and comprehensive coverage of barrier penetration (quantum mechanical tunneling) that touches upon hot topics, such as superconductivity and scanning tunneling microscopy Problems given at the end of each chapter help students to master concepts

The Complete Idiot S Guide To Chemistry 3rd Edition

Author : Ian Guch
ISBN : 9781615644629
Genre : Science
File Size : 76. 20 MB
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This book follows a standard math-based chemistry curriculum. Author is an award-winning teacher who has taught at both the high school and college levels.

Molecular Quantum Mechanics

Author : Peter W. Atkins
ISBN : 9780199541423
Genre : Science
File Size : 21. 90 MB
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This text unravels those fundamental physical principles which explain how all matter behaves. It takes us from the foundations of quantum mechanics, through quantum models of atomic, molecular, and electronic structure, and on to discussions of spectroscopy, and the electronic and magnetic properties of molecules.

Quantum Chemistry

Author : R.K. Prasad
ISBN : 9788122417401
Genre : Quantum chemistry
File Size : 64. 2 MB
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The Third Edition Of Quantum Chemistry Is A Fully Updated Textbook Covering The Model Syllabus For M.Sc General Course Recently Circulated By Ugc To All Indian Universities.The Book Contains The Developments That Led To Me Evolution Of Quantum Mechanics As Well As The Basic Concepts Of Quantum Mechanical Formalism In As Simple Terms As Possible. The Exposition Of The Principles Is Followed By Application To Transnational Motion Of Micro Particles (With Infinite And Finite Barriers), Vibrational And Rotational Motions, Perturbation And Variation Methods Atomic Structure, Etc.The Ories Of Chemical Bond - Molecular Orbital And Valence Bond - In Diatomic As Well As Polyatomic Molecules Are Elaborately Expanded With Sufficient Examples. In Poly Electronic Atoms And Polyatomic Molecules, The Apparently Complicated Theories - Hfrscf, Configuration Interaction, Extended Huckel Theory, Etc. Are Presented With Utmost Clarity And Examples. The Chapter On Molecular Symmetry And Group Theory, Which Find Frequent Applications In Simplifying Problems Particularly In Mo Treatment, Is An Additional Feature. Steps Involved In Mathematical Derivations Are Presented In Full Leaving No Ambiguity. Illustrative Examples And Practice Problems, With Hints Provided, Are Given In Every Chapter. The Book May Prove To Be A Self-Educator.

Mathematics For Quantum Chemistry

Author : Jay Martin Anderson
ISBN : 9780486151489
Genre : Science
File Size : 33. 59 MB
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Introduction to problems of molecular structure and motion covers calculus of orthogonal functions, algebra of vector spaces, and Lagrangian and Hamiltonian formulation of classical mechanics. Answers to problems. 1966 edition.

Thermodynamics Statistical Thermodynamics And Kinetics

Author : Thomas Engel
ISBN : UCSD:31822034306787
Genre : Science
File Size : 80. 54 MB
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Thermodynamics, Statistical Thermodynamics, and Kinetics 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 readers focused on the most important concepts and to provide greater clarity. Applications woven throughout each chapter demonstrate to readers 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 readers excited about this dynamic branch of science. Quantum Chemistry and Spectroscopy is a split text (from Physical Chemistry) and 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. Fundamental Concepts of Thermodynamics; Heat, Work, Internal Energy, Enthalpy, and the First Law of Thermodynamics; The Importance of State Functions: Internal Energy and Enthalpy; Thermochemistry; Entropy and the Second and Third Law of Thermodynamics; Chemical Equilibrium; The Properties of Real Gases; The Relative Stability of Solids, Liquids, and Gases; Ideal and Real Solutions; Electrolyte Solutions; Electrochemical Cells, Batteries, and Fuel Cells; Probability; The Boltzmann Distribution; Ensemble and Molecular Partition Functions; Statistical Thermodynamics; Kinetic Theory of Gases; Transport Phenomena; Elementary Chemical Kinetics; Complex Reaction Mechanisms. For all readers interested in learning the core topics of quantum chemistry.

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