Computational Quantum Chemistry (With CD-ROM)
By Charles M. Quinn
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Publisher: Academic Press
Number Of Pages: 260
Publication Date: 2002-03
ISBN-10 / ASIN: 0125696825
ISBN-13 / EAN: 9780125696821
Binding: Hardcover
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Book Description:
Computational Quantum Chemistry removes much of the mystery of modern computer programs for molecular orbital calculati** by showing how to develop Excel spreadsheets to perform model calculati** and investigate the properties of basis sets. Using the book together with the CD-ROM provides a unique interactive learning tool. In addition, because of the integration of theory with working examples on the CD-ROM, the reader can apply advanced features available in the spreadsheet to other applicati** in chemistry, physics, and a variety of disciplines that require the solution of differential equati**.
This book and CD-ROM makes a valuable companion for instructors, course designers, and students. It is suitable for direct applicati** in practical courses in theoretical chemistry and atomic physics, as well as for teaching advanced features of Excel in IT courses.
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