Computational Quantum Chemistry

Computational Quantum Chemistry

by Alan Hinchcliffe, Alan Hinchliffe
     
 
An introduction to the computer application of quantum-mechanical techniques to problems involving molecular structure and properties. Covers a wide range of methods, each supported by examples, and considers the power of computational quantum chemistry as a predictive tool. Also uses ab initio models in validating experimental evidence.

Overview

An introduction to the computer application of quantum-mechanical techniques to problems involving molecular structure and properties. Covers a wide range of methods, each supported by examples, and considers the power of computational quantum chemistry as a predictive tool. Also uses ab initio models in validating experimental evidence.

Editorial Reviews

Booknews
Hinchliffe (chemistry, U. of Manchester Inst. of Sci. & Tech.) provides a brief introduction to ab initio calculations useful in experimental, theoretical, and physical chemistry. Emphasis is on application of computer methods in validating and supporting experimental work, including specific details on error identification and reliability. Annotation c. Book News, Inc., Portland, OR (booknews.com)

Product Details

ISBN-13:
9780471917168
Publisher:
Wiley, John & Sons, Incorporated
Publication date:
11/28/1988
Pages:
112
Product dimensions:
5.19(w) x 8.17(h) x 0.61(d)

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