Electron Density And Chemical Bonding Ii

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Electron Density And Chemical Bonding Ii

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Author : Dietmar Stalke
language : en
Publisher: Springer
Release Date : 2012-06-05

Electron Density And Chemical Bonding Ii written by Dietmar Stalke and has been published by Springer this book supported file pdf, txt, epub, kindle and other format this book has been release on 2012-06-05 with Science categories.

T. Koritsanszky, A. Volkov, M. Chodkiewicz: New Directions in Pseudoatom-Based X-Ray Charge Density Analysis.- B. Dittrich, D. Jayatilaka: Reliable Measurements of Dipole Moments from Single-Crystal Diffraction Data and Assessment of an In-Crystal Enhancement.- B. Engels, Th. C. Schmidt, C. Gatti, T. Schirmeister, R.F. Fink: Challenging Problems in Charge Density Determination: Polar Bonds and Influence of the Environment.- S. Fux, M. Reiher: Electron Density in Quantum Theory.- K. Meindl, J.Henn: Residual Density Analysis.- C. Gatti: The Source Function Descriptor as a Tool to Extract Chemical Information from Theoretical and Experimental Electron Densities.

Electron Density And Chemical Bonding

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Author :
language : en
Publisher:
Release Date : 2012

Electron Density And Chemical Bonding written by and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 2012 with Chemical bonds categories.

Electron Distributions And The Chemical Bond

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Author : Philip Coppens
language : en
Publisher: Springer Science & Business Media
Release Date : 2012-12-06

Electron Distributions And The Chemical Bond written by Philip Coppens and has been published by Springer Science & Business Media this book supported file pdf, txt, epub, kindle and other format this book has been release on 2012-12-06 with Science categories.

This book represents the proceedings of a symposium held at the Spring 1981 ACS meeting in Atlanta. The symposium brought together Theoretical Chemists, Solid State Physicists, Experimen tal Chemists and Crystallographers. One of its major aims was to increase interaction between these diverse groups which often use very different languages to describe similar concepts. The devel opment of a common language, or at least the acquisition of a multilingual capability, is a necessity if the field is to prosper. Much depends in this field on the interplay between theory and experiment. Accordingly this volume begins with two introduc tory chapters, one theoretical and the other experimental, which contain much of the background material needed for a through under standing of the field. The remaining sections describe a wide variety of applications and illustrate, we believe, the central role of charge densities in the understanding of chemical bonding. We are most indebted to the Divisions of Inorganic and Phy sical Chemistry of the American Chemical Society, which provided the stimulus for the symposium and gave generous financial support. We also gratefully acknowledge financial support from the Special Educational Opportunities Program of the Petroleum Research Fund administered by the American Chemical Society, which made exten sive participation by speakers from abroad possible.

Electron Density And Bonding In Crystals

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Author : V.G Tsirelson
language : en
Publisher: CRC Press
Release Date : 2020-11-25

Electron Density And Bonding In Crystals written by V.G Tsirelson and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2020-11-25 with Science categories.

Electron Density and Bonding in Crystals: Principles, Theory and X-Ray Diffraction Experiments in Solid State Physics and Chemistry provides a comprehensive, unified account of the use of diffraction techniques to determine the distribution of electrons in crystals. The book discusses theoretical and practical techniques, the application of electron density studies to chemical bonding, and the determination of the physical properties of condensed matter. The book features the authors' own key contributions to the subject as well a thorough, critical summary of the extensive literature on electron density and bonding. Logically organized, coverage ranges from the theoretical and experimental basis of electron density determination to its impact on investigations of the nature of the chemical bond and its uses in determining electromagnetic and optical properties of crystals. The main text is supplemented by appendices that provide clear, concise guidance on aspects such as systems of units, quantum theory of atomic vibrations, atomic orbitals, and creation and annihilation operators. The result is a valuable compendium of modern knowledge on electron density distributions, making this reference a standard for crystallographers, condensed matter physicists, theoretical chemists, and materials scientists.

Electron Density And Chemical Bonding

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Author : Dietmar Stalke
language : en
Publisher:
Release Date : 2012

Electron Density And Chemical Bonding written by Dietmar Stalke and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 2012 with Chemical bonds categories.

Electron Density And Chemical Bonding I

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Author : Dietmar Stalke
language : en
Publisher: Springer
Release Date : 2012-06-07

Electron Density And Chemical Bonding I written by Dietmar Stalke and has been published by Springer this book supported file pdf, txt, epub, kindle and other format this book has been release on 2012-06-07 with Science categories.

D. Stalke, U. Flierler: More than Just Distances from Electron Density Studies.- A.O. Madsen: Modeling and Analysis of Hydrogen Atoms.- B.B. Iversen/J. Overgaard: Charge Density Methods in Hydrogen Bond Studies.- U. Flierler, D. Stalke: Some Main Group Chemical Perceptions in the Light of Experimental Charge Density Investigations.- D. Leusser: Electronic Structure and Chemical Properties of Lithium Organics Seen Through the Glasses of Charge Density.- L. J. Farrugia, P. Macchi: Bond Orders in Metal–Metal Interactions Through Electron Density Analysis.- W. Scherer, V. Herz, Ch. Hauf: On the Nature of β-Agostic Interactions: A Comparison Between the Molecular Orbital and Charge Density Picture.

The Chemical Bond

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Author : Gernot Frenking
language : en
Publisher: John Wiley & Sons
Release Date : 2014-07-08

The Chemical Bond written by Gernot Frenking and has been published by John Wiley & Sons this book supported file pdf, txt, epub, kindle and other format this book has been release on 2014-07-08 with Science categories.

This is the perfect complement to "Chemical Bonding - Across the Periodic Table" by the same editors, who are two of the top scientists working on this topic, each with extensive experience and important connections within the community. The resulting book is a unique overview of the different approaches used for describing a chemical bond, including molecular-orbital based, valence-bond based, ELF, AIM and density-functional based methods. It takes into account the many developments that have taken place in the field over the past few decades due to the rapid advances in quantum chemical models and faster computers.

Electron Density And Chemical Bonding I

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Author : Dietmar Stalke
language : en
Publisher: Springer
Release Date : 2012-06-05

Electron Density And Chemical Bonding I written by Dietmar Stalke and has been published by Springer this book supported file pdf, txt, epub, kindle and other format this book has been release on 2012-06-05 with Science categories.

D. Stalke, U. Flierler: More than Just Distances from Electron Density Studies.- A.O. Madsen: Modeling and Analysis of Hydrogen Atoms.- B.B. Iversen/J. Overgaard: Charge Density Methods in Hydrogen Bond Studies.- U. Flierler, D. Stalke: Some Main Group Chemical Perceptions in the Light of Experimental Charge Density Investigations.- D. Leusser: Electronic Structure and Chemical Properties of Lithium Organics Seen Through the Glasses of Charge Density.- L. J. Farrugia, P. Macchi: Bond Orders in Metal–Metal Interactions Through Electron Density Analysis.- W. Scherer, V. Herz, Ch. Hauf: On the Nature of β-Agostic Interactions: A Comparison Between the Molecular Orbital and Charge Density Picture.

Chemical Bonding And Molecular Geometry

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Author : Ronald James Gillespie
language : en
Publisher: Oxford University Press on Demand
Release Date : 2001

Chemical Bonding And Molecular Geometry written by Ronald James Gillespie and has been published by Oxford University Press on Demand this book supported file pdf, txt, epub, kindle and other format this book has been release on 2001 with Science categories.

Ideal for undergraduate and first-year graduate courses in chemical bonding, Chemical Bonding and Molecular Geometry: From Lewis to Electron Densities can also be used in inorganic chemistry courses. Authored by Ronald Gillespie, a world-class chemist and expert on chemical bonding, and Paul Popelier of the University of Manchester Institute of Science and Technology, this text provides students with a comprehensive and detailed introduction to the principal models and theories of chemical bonding and geometry. It also serves as a useful resource and an up-to-date introduction to modern developments in the field for instructors teaching chemical bonding at any level. Features: * Shows students how the concept of the chemical bond has developed from its earliest days, through Lewis's brilliant concept of the electron pair bond and up to the present day * Presents a novel, non-traditional approach that emphasizes the importance of the Pauli principle as a basis for understanding bonding * Begins with the fundamental classical concepts and proceeds through orbital models to recent ideas based on the analysis of electron densities, which help to clarify and emphasize many of the limitations of earlier models * Provides a thorough and up-to-date treatment of the well-known valence-shell electron pair (VSEPR) model (which was first formulated and developed by author Ronald Gillespie) and the more recent ligand close-packing (LCP) model * Presents a unique pictorial and nonmathematical discussion of the analysis of electron density distributions using the atoms in molecules (AIM) theory * Emphasizes the relationships between these various models, giving examples of their uses, limitations, and comparative advantages and disadvantages

Molecules And The Chemical Bond

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Author : Henry A. Bent
language : en
Publisher: Trafford Publishing
Release Date : 2011

Molecules And The Chemical Bond written by Henry A. Bent and has been published by Trafford Publishing this book supported file pdf, txt, epub, kindle and other format this book has been release on 2011 with Education categories.

MOLECULES AND THE CHEMICAL BOND Chemistry Simplified This highly original book by a famous chemistry teacher about general chemistry in a new key may change how teachers teach - - Atomic Theory - The Mole Concept and Avogadro's Constant - The Gas Laws - Solving Problems in Chemical Stoichiometry - The Saturation and Directional Character of Chemical Affinity - The Pauli Exclusion Principle - Linnett's Double Spin Set Theory - Pauling's Rules of Crystal Chemistry - The Octet Rule - Lewis Structures for O2, NO, CO, SO2 and SO3 - Construction of Bond Diagrams - VSEPR Theory - Dative Bonding - Multicenter Bonding - Bonding in Metals - pH Calculations - The Periodic Table - The Energy Function and the First Law of Thermodynamics - The Entropy Function and the Second Law of Thermodynamics - How an Inductive Science Advances