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Table of contents (11 chapters)
Keywords
About this book
With detailed analysis and examples from around the world, Applying Molecular and Materials Modeling describes the science, applications, and infrastructures that have proven successful. Computational quantum chemistry, molecular simulations, informatics, desktop graphics, and high-performance computing all play important roles. At the same time, the best technology requires the right practitioners, the right organizational structures, and - most of all - a clearly understood blend of imagination and realism that propels technological advances. This book is itself a powerful tool to help scientists, engineers, and managers understand and take advantage of these advances.
Authors and Affiliations
Bibliographic Information
Book Title: Applying Molecular and Materials Modeling
Authors: Phillip R. Westmoreland, Peter A. Kollman, Anne M. Chaka, Peter T. Cummings, Keiji Morokuma, Matthew Neurock, Ellen B. Stechel, … Priya Vashishta
DOI: https://doi.org/10.1007/978-94-017-0765-7
Publisher: Springer Dordrecht
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eBook Packages: Springer Book Archive
Copyright Information: Springer Science+Business Media Dordrecht 2002
Hardcover ISBN: 978-1-4020-0906-8Published: 31 October 2002
Softcover ISBN: 978-90-481-6134-8Published: 09 December 2010
eBook ISBN: 978-94-017-0765-7Published: 17 April 2013
Edition Number: 1
Number of Pages: XXIV, 574
Topics: Computer Applications in Chemistry, Industrial Chemistry/Chemical Engineering, Inorganic Chemistry, Pharmacy