Literature DB >> 23697401

Communication: Pressure fluctuations in isotropic solids and fluids.

J P Wittmer1, H Xu, P Polińska, F Weysser, J Baschnagel.   

Abstract

Comparing isotropic solids and fluids at either imposed volume or pressure, we investigate various correlations of the instantaneous pressure and its ideal and excess contributions. Focusing on the compression modulus K, it is emphasized that the stress fluctuation representation of the elastic moduli may be obtained directly (without a microscopic displacement field) by comparing the stress fluctuations in conjugated ensembles. This is made manifest by computing the Rowlinson stress fluctuation expression K(row) of the compression modulus for NPT-ensembles. It is shown theoretically and numerically that K(row∣P) = P(id)(2 - P(id)∕K) with P(id) being the ideal pressure contribution.

Year:  2013        PMID: 23697401     DOI: 10.1063/1.4807305

Source DB:  PubMed          Journal:  J Chem Phys        ISSN: 0021-9606            Impact factor:   3.488


  1 in total

1.  Compressibility and pressure correlations in isotropic solids and fluids.

Authors:  J P Wittmer; H Xu; P Polińska; C Gillig; J Helfferich; F Weysser; J Baschnagel
Journal:  Eur Phys J E Soft Matter       Date:  2013-11-22       Impact factor: 1.890

  1 in total

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