Introduction to Computational Chemistry Paperback Frank Jensen

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Item specifics

Condition
Like New: A book that has been read, but looks new. The book cover has no visible wear, and the dust ...
Book Title
Introduction to Computational Chemistry Paperback Frank Jensen
Subject
Chemistry
ISBN
9780471984252
Category

About this product

Product Identifiers

Publisher
Wiley & Sons, Incorporated, John
ISBN-10
0471984256
ISBN-13
9780471984252
eBay Product ID (ePID)
940085

Product Key Features

Number of Pages
446 Pages
Publication Name
Introduction to Computational Chemistry
Language
English
Publication Year
1998
Subject
Chemistry / Physical & Theoretical
Type
Textbook
Author
Frank Jensen
Subject Area
Science
Format
Trade Paperback

Dimensions

Item Height
1 in
Item Weight
30.1 Oz
Item Length
9.7 in
Item Width
7.5 in

Additional Product Features

Intended Audience
Scholarly & Professional
LCCN
98-024091
Dewey Edition
22
Illustrated
Yes
Dewey Decimal
541.0285
Table Of Content
Force Field Methods. Electronic Structure Methods. Electron Correlation Methods. Basis Sets. Density Functional Theory. Valence Bond Methods. Relativistic Methods. Wave Function Analysis. Molecular Properties. Illustrating the Concepts. Transition State Theory and Statistical Mechanics. Change of Coordinate System. Optimization Techniques. Qualitative Theories. Simulations, Time-dependent Methods and Solvation Models. Concluding Remarks. Appendices. Index.
Synopsis
Introduction to Computational Chemistry Frank Jensen Odense University, Denmark Computational chemistry is a rapidly emerging and developing area, combining theoretical models with computers to investigate a variety of chemical phenomena. Increasingly applied throughout chemistry, computational methods are becoming an integral part of modern chemical research. Introduction to Computational Chemistry provides a comprehensive account of the fundamental principles underlying different methods, ranging from classical to sophisticated quantum models. Although the main focus is on molecular structures and energetics, subjects such as molecular properties, dynamical aspects, relativistic methods and qualitative models are also covered. Introduction to Computational Chemistry features: * Coverage from first principles through to the latest advances. * Relatively self-contained chapters, allowing for flexibility in the order in which they can be read. * A web site containing additional information. Suitable for students and researchers entering the field of computational chemistry, it is also an essential reference for procedures commonly cited in computational chemistry literature. No prior knowledge of concepts specific to computational chemistry is necessary, although some understanding of introductory quantum mechanics and elementary mathematics is assumed., Computational chemistry, solving chemically related problems through calculation encompasses many different subjects and techniques, and is an emerging and widely used subfield of theoretical chemistry., Computational chemistry is a rapidly emerging and developing area, combining theoretical models with computers to investigate a variety of chemical phenomena. Increasingly applied throughout chemistry, computational methods are becoming an integral part of modern chemical research. Introduction to Computational Chemistry provides a comprehensive account of the fundamental principles underlying different methods, ranging from classical to sophisticated quantum models. Although the main focus is on molecular structures and energetics, subjects such as molecular properties, dynamical aspects, relativistic methods and qualitative models are also covered. Introduction to Computational Chemistry features:Coverage from first principles through to the latest advances.Relatively self-contained chapters, allowing for flexibility in the order in which they can be read.A web site containing additional information.Suitable for students and researchers entering the field of computational chemistry, it is also an essential reference for procedures commonly cited in computational chemistry literature. No prior knowledge of concepts specific to computational chemistry is necessary, although some understanding of introductory quantum mechanics and elementary mathematics is assumed.
LC Classification Number
QD455.3.E4J46 1999

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