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Introduction to Molecular Dynamics and Chemical Kinetics (Hardcover)
Loot Price: R4,355
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Introduction to Molecular Dynamics and Chemical Kinetics (Hardcover)
Expected to ship within 12 - 17 working days
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The most complete introduction available to molecular dynamics and
the calculation of rate of reaction
This unique textbook provides a unified treatment of molecular
reaction dynamics and chemical kinetics in the gas phase, on
surfaces, and in solution. It goes beyond the standard textbook
topics related to reactions to include concepts from molecular
dynamics calculations as well as methods for treating reactions in
solution.
Featuring a thorough mathematical presentation that fosters
understanding and mastery of all topics covered, Introduction to
Molecular Dynamics and Chemical Kinetics:
* Covers all the basic concepts and practices related to
mathematical model systems used to calculate probability for
chemical reactions
* Provides complete theoretical discussions, including areas of
Kramers' theory and Marcus theory dealing with reactions in
solutions
* Introduces an innovative system of molecular units for molecular
dynamics calculations--provides conventional units as well
* Describes all mathematical derivations necessary for obtaining
formulas
* Uses numerous exercises to clarify both the derivations in the
text and the effects being studied
* Explains how to solve the exercises in its appended "Answers"
section
* Includes special appendices that summarize background
information needed to perform required mathematical calculations
and understand relevant theories
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