| Literature DB >> 12633440 |
Nicolas Giovambattista1, Sergey V Buldyrev, Francis W Starr, H Eugene Stanley.
Abstract
We investigate the spatially heterogeneous dynamics in the extended simple point charge model of water 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. We also examine the time and temperature dependence of these transient clusters.Entities:
Year: 2003 PMID: 12633440 DOI: 10.1103/PhysRevLett.90.085506
Source DB: PubMed Journal: Phys Rev Lett ISSN: 0031-9007 Impact factor: 9.161