Variational Characterization of Free Energy: Theory and Algorithms
نویسندگان
چکیده
The article surveys and extends variational formulations of the thermodynamic free energy and discusses their information-theoretic content from the perspective of mathematical statistics. We revisit the well-known Jarzynski equality for nonequilibrium free energy sampling within the framework of importance sampling and Girsanov change-of-measure transformations. The implications of the different variational formulations for designing efficient stochastic optimization and nonequilibrium simulation algorithms for computing free energies are discussed and illustrated.
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ورودعنوان ژورنال:
- Entropy
دوره 19 شماره
صفحات -
تاریخ انتشار 2017