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In recent years the interaction between dynamical systems theory and nonequilibrium statistical mechanics has been enormous. The discovery of fluctuation theorems as a fundamental structure common to almost all nonequilibrium systems, and the connections with the free energy calculation methods of Jarzynski and Crooks, have excited both theorists and experimentalists. This graduatelevel book charts the development and theoretical analysis of molecular dynamics as applied to equilibrium and nonequilibrium systems. Designed for both researchers in the field and graduate students of physics, it connects molecular dynamics simulation with the mathematical theory to understand nonequilibrium steady states. It also provides a link between the atomic, nano, and macro worlds. The book ends with an introduction to the use of nonequilibrium statistical mechanics to justify a thermodynamic treatment of nonequilibrium steady states, and gives a direction to further avenues of exploration.
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