Microscopic expressions for the thermodynamic temperature

Owen G. Jepps, Gary Ayton, and Denis J. Evans
Phys. Rev. E 62, 4757 – Published 1 October 2000
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Abstract

We show that arbitrary phase space vector fields can be used to generate phase functions whose ensemble averages give the thermodynamic temperature. We describe conditions for the validity of these functions in periodic boundary systems and the molecular dynamics (MD) ensemble, and test them with a short-ranged potential MD simulation.

  • Received 19 November 1998

DOI:https://doi.org/10.1103/PhysRevE.62.4757

©2000 American Physical Society

Authors & Affiliations

Owen G. Jepps, Gary Ayton, and Denis J. Evans

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

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Issue

Vol. 62, Iss. 4 — October 2000

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