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Item Details
Title: A HANDBOOK OF COMPUTATIONAL CHEMISTRY
PRACTICAL GUIDE TO CHEMICAL STRUCTURE AND ENERGY CALCULATIONS
By: Tim Clark
Format: Hardback

List price: £214.95
Our price: £193.46
Discount:
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ISBN 10: 0471882119
ISBN 13: 9780471882114
Availability: Usually dispatched within 1-3 weeks.
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Publisher: JOHN WILEY AND SONS LTD
Pub. date: 18 September, 1985
Pages: 352
Description: Although no training in theoretical chemistry is needed, the book does assume an adequate knowledge of symmetry operations and point groups, which are used throughout.
Synopsis: In an attempt to introduce practical chemists, experimental researchers and students to chemical structure and energy calculations, the ability to "determine" the structure, stability, and other properties of an unknown molecule without synthesizing it opens up new chemical possibilities and turns fantasy molecules into accessible research objects. Although no training in theoretical chemistry is needed, the book does assume an adequate knowledge of symmetry operations and point groups, which are used throughout without further explanation. In both the molecular mechanics and Molecular Orbital (M0) sections, the emphasis is on the practical aspects of performing useful calculations and understanding the output.
Illustrations: illustrations, index
Publication: US
Imprint: John Wiley & Sons Inc
Returns: Returnable
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