Name: computational quantum chemistry
SKU: 4249822
Author: charles m. quinn
ISBN: 9780080488530

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Type

Physical Book

Publisher

elsevier science ; academic press

Author

charles m. quinn

Topic

chemistry

Year

2002

Language

English

Pages

237

ISBN

9780080488530

ISBN13

9780080488530

computational quantum chemistry

Charles M. Quinn (Author) · elsevier science ; academic press · Physical Book

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Synopsis "computational quantum chemistry"

computational quantum chemistry removes much of the mystery of modern computer programs for molecular orbital calculations by showing how to develop excel spreadsheets to perform model calculations 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 applications in chemistry, physics, and a variety of disciplines that require the solution of differential equations.this book and cd-rom makes a valuable companion for instructors, course designers, and students. it is suitable for direct applications in practical courses in theoretical chemistry and atomic physics, as well as for teaching advanced features of excel in it courses.