Time-dependent response theory and nonequilibrium free-energy relations

Stephen R. Williams and Denis J. Evans
Phys. Rev. E 78, 021119 – Published 15 August 2008

Abstract

The mathematics of time-dependent nonlinear response theory frequently leads to results which although formally exact, are not amenable to experimental application or even to use in computer simulations. Here we give a rigorous derivation of a tractable expression for the thermostatted nonlinear response of classical many body systems to time-dependent dissipative fields. The theory also allows for the concurrent parametric transformation of the system Hamiltonian. Our analysis shows once again the intimate relationship between nonequilibrium free-energy relations such as the Jarzynski equality and nonlinear response theory. We make a few remarks concerning the maximum entropy production approximation.

  • Figure
  • Received 5 May 2008

DOI:https://doi.org/10.1103/PhysRevE.78.021119

©2008 American Physical Society

Authors & Affiliations

Stephen R. Williams* and Denis J. Evans

  • Research School of Chemistry, The Australian National University, Canberra, ACT 0200, Australia

  • *swilliams@rsc.anu.edu.au
  • evans@rsc.anu.edu.au

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Issue

Vol. 78, Iss. 2 — August 2008

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