"Covering both intramolecular and reaction dynamics, this comprehensive and up-to-date reference/text presents the most important theoretical and computational approaches to the study of energy transfer within and between molecules - discussing the application of these approache…
Designed to help novices learn to perform molecular dynamics simulations with an emphasis on methods rather than applications. The volume includes a discussion of how modern notions of chaos and nonlinear dynamics explain why molecular dynamics works, and a review of elements of…
Presents a balanced presentation of the macroscopic view of empirical kinetics and the microscopic molecular viewpoint of chemical dynamics. Stressing interconnections between phenomenological chemical kinetics and molecular reaction dynamics, the book discusses reactions in gas…