Electrostatics of Atoms and Molecules

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Author :
Release : 2000
Genre : Electrostatics
Kind :
Book Rating : 968/5 ( reviews)

Electrostatics of Atoms and Molecules - read free eBook in online reader or directly download on the web page. Select files or add your book in reader. Download and read online ebook Electrostatics of Atoms and Molecules write by Shridhar R. Gadre. This book was released on 2000. Electrostatics of Atoms and Molecules available in PDF, EPUB and Kindle. This book introduces the subject of molecular electrostatics to postgraduate students, teachers and young researchers in chemistry, physics and biology. It discusses rigorous as well as applied aspects of the molecular electrostatic potential (MESP) and provides an essence of relevant mathematical arguments, without going into detailed derivations. A number of color illustrations highlight the salient features of MESP.

Electrostatics at the Molecular Level

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Author :
Release : 2018
Genre : SCIENCE
Kind :
Book Rating : 842/5 ( reviews)

Electrostatics at the Molecular Level - read free eBook in online reader or directly download on the web page. Select files or add your book in reader. Download and read online ebook Electrostatics at the Molecular Level write by Ulrich Zürcher (Professor of physics). This book was released on 2018. Electrostatics at the Molecular Level available in PDF, EPUB and Kindle. Electrostatic forces are essential for the hierarchical structure of matter: electrons are bound to the atomic nucleus by electrostatic forces; atoms carry (partial) charges and ions with opposite charges attract and form (chemical) bonds. Small residual electrostatic forces between molecules allow them to form macroscopic structures such as crystals. Electrostatic interactions explain pseudo-forces used in popular computer programs used to model the properties of atoms, molecules, and proteins. By beginning with the basics and then diving deeper into the topic, this book aims to familiarize the reader with electrostatic forces at the atomic and molecular level.

Molecular Electrostatic Potentials

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Author :
Release : 1996-11-22
Genre : Science
Kind :
Book Rating : 859/5 ( reviews)

Molecular Electrostatic Potentials - read free eBook in online reader or directly download on the web page. Select files or add your book in reader. Download and read online ebook Molecular Electrostatic Potentials write by J.S. Murray. This book was released on 1996-11-22. Molecular Electrostatic Potentials available in PDF, EPUB and Kindle. Over the past 25 years, the molecular electrostatic potential has become firmly established as an effective guide to molecular interactions. With the recent advances in computational technology, it is currently being applied to a variety of important chemical and biological systems. Its range of applicability has expanded from primarily a focus on sites for electrophilic and nucleophilic attack to now include solvent effects, studies of zeolite, molecular cluster and crystal behavior, and the correlation and prediction of a wide range of macroscopic properties. Moreover, the increasing prominence of density functional theory has raised the molecular electrostatic potential to a new stature on a more fundamental conceptual level. It is rigorously defined in terms of the electron density, and has very interesting topological characteristics since it explicitly reflects opposing contributions from the nuclei and the electrons. This volume opens with a survey chapter by one of the original pioneers of the use of the electrostatic potential in studies of chemical reactivity, Jacopo Tomasi. Though the flow of the succeeding chapters is not stringently defined, the overall trend is that the emphasis changes gradually from methodology to applications. Chapters discussing more theoretical topics are placed near the end. Readers will find the wide variety of topics provided by an international group of authors both convincing and useful.

Electrostatics at the Molecular Level

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Release : 2018-10-24
Genre : Science
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Book Rating : 865/5 ( reviews)

Electrostatics at the Molecular Level - read free eBook in online reader or directly download on the web page. Select files or add your book in reader. Download and read online ebook Electrostatics at the Molecular Level write by Ulrich Zürcher. This book was released on 2018-10-24. Electrostatics at the Molecular Level available in PDF, EPUB and Kindle. Electrostatic forces are essential for the hierarchical structure of matter: electrons are bound to the atomic nucleus by electrostatic forces; atoms carry (partial) charges and ions with opposite charges attract and form (chemical) bonds. Small residual electrostatic forces between molecules allow them to form macroscopic structures such as crystals. Electrostatic interactions explain pseudo-forces used in popular computer programs used to model properties of atoms, molecules, and proteins. By beginning with the basics and then diving deeper into the topic, this book aims to familiarize the reader with electrostatic forces at the atomic and molecular level.

Chemical Applications of Atomic and Molecular Electrostatic Potentials

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Release : 2013-06-29
Genre : Science
Kind :
Book Rating : 34X/5 ( reviews)

Chemical Applications of Atomic and Molecular Electrostatic Potentials - read free eBook in online reader or directly download on the web page. Select files or add your book in reader. Download and read online ebook Chemical Applications of Atomic and Molecular Electrostatic Potentials write by Peter Politzer. This book was released on 2013-06-29. Chemical Applications of Atomic and Molecular Electrostatic Potentials available in PDF, EPUB and Kindle. On March 26-27, 1980, a symposium organized by one of us (P. P. ) was held at the l79th American Chemical Society National ~1eeting in Houston, Texas, under the sponsorship of the Theoretical Chemistry Subdivision of the Division of Physical Chemistry. The symposium was entitled "The Role of the Electrostatic Potential in Chemistry," and it served as a stimulus for this book. The original scope and coverage have been broadened, however; included here, in addition to contributions from the eleven invited symposium speakers and two of the poster-session participants, are four papers that were specially invited for this book. Furthermore, several authors have taken this opportunity to present at least partial reviews of the areas being discussed. Most of the manuscripts were completed in the late spring and early summer of 1980. We hope that this book will achieve two goals: First, we are trying to provide an overall picture, including recent advances, of current chemical research, both fundamental and applied, involving the electrostatic potential. Second, we want to convey an appreci ation of both the powers and also the limitations of the electro static potential approach. In order to achieve these goals, we have selected contributors whose research areas provide a very broad coverage of the field. Throughout the book, we have used a. u.