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Phys. Rev. E 80, 041502 (2009) [6 pages]

Hidden scale invariance in molecular van der Waals liquids: A simulation study

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Thomas B. Schrøder, Ulf R. Pedersen, Nicholas P. Bailey, Søren Toxvaerd, and Jeppe C. Dyre
DNRF Centre “Glass and Time,” IMFUFA, Department of Sciences, Roskilde University, Post Box 260, DK-4000 Roskilde, Denmark

Received 15 May 2008; revised 27 July 2009; published 13 October 2009

Results from molecular dynamics simulations of two viscous molecular model liquids—the Lewis-Wahnström model of orthoterphenyl and an asymmetric dumbbell model—are reported. We demonstrate that the liquids have a “hidden” approximate scale invariance: equilibrium potential energy fluctuations are accurately described by inverse power-law (IPL) potentials, the radial distribution functions are accurately reproduced by the IPL’s, and the radial distribution functions obey the IPL predicted scaling properties to a good approximation. IPL scaling of the dynamics also applies—with the scaling exponent predicted by the equilibrium fluctuations. In contrast, the equation of state does not obey the IPL scaling. We argue that our results are general for van der Waals liquids, but do not apply, e.g., for hydrogen-bonded liquids.

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© 2009 The American Physical Society

URL:
http://link.aps.org/doi/10.1103/PhysRevE.80.041502
DOI:
10.1103/PhysRevE.80.041502
PACS:
64.70.P−, 64.70.Q−