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arxiv: cond-mat/0209395 · v1 · pith:QAUGPFMRnew · submitted 2002-09-17 · ❄️ cond-mat.soft · cond-mat.stat-mech

Connection between Adam-Gibbs Theory and Spatially Heterogeneous Dynamics

classification ❄️ cond-mat.soft cond-mat.stat-mech
keywords dynamicsadam-gibbsclustersheterogeneousmassspatiallytheoryaverage
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We investigate the spatially heterogeneous dynamics in the SPC/E model of water by using molecular dynamics simulations. We relate the average mass $n^*$ of mobile particle clusters to the diffusion constant and the configurational entropy. Hence, $n^*$ can be interpreted as the mass of the ``cooperatively rearranging regions'' that form the basis of the Adam-Gibbs theory of the dynamics of supercooled liquids. Finally, we examine the time and temperature dependence of these transient clusters.

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