4.7 Article

Emergence of complex behavior in gelling systems starting from simple behavior of single clusters

Journal

JOURNAL OF CHEMICAL PHYSICS
Volume 131, Issue 19, Pages -

Publisher

AMER INST PHYSICS
DOI: 10.1063/1.3264949

Keywords

aggregation; gels; liquid structure; molecular dynamics method; percolation; solid-liquid transformations; sols

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A theoretical and numerically study of dynamical properties in the sol-gel transition is presented. In particular, the complex phenomenology observed experimentally and numerically in gelling systems is reproduced in the framework of percolation theory, under simple assumptions on the relaxation of single clusters. By neglecting the correlation between particles belonging to different clusters, the quantities of interest (such as the self intermediate scattering function, the dynamical susceptibility, the Van-Hove function, and the non-Gaussian parameter) are written as superposition of those due to single clusters. Connection between these behaviors and the critical exponents of percolation are given. The theoretical predictions are checked in a model for permanent gels, where bonds between monomers are described by a finitely extendable nonlinear elastic potential. The data obtained in the numerical simulations are in good agreement with the analytical predictions.

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