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Unification of classical nucleation theories via a unified Itô-Stratonovich stochastic equation.

作者信息

Durán-Olivencia Miguel A, Lutsko James F

机构信息

Department of Chemical Engineering, Imperial College London, South Kensington Campus, London SW7 2AZ, United Kingdom.

Center for Nonlinear Phenomena and Complex Systems, Université Libre de Bruxelles, Code Postal 231, Boulevard du Triomphe, 1050 Brussels, Belgium.

出版信息

Phys Rev E Stat Nonlin Soft Matter Phys. 2015 Sep;92(3):032407. doi: 10.1103/PhysRevE.92.032407. Epub 2015 Sep 22.

Abstract

Classical nucleation theory (CNT) is the most widely used framework to describe the early stage of first-order phase transitions. Unfortunately, the different points of view adopted to derive it yield different kinetic equations for the probability density function, e.g., Zeldovich-Frenkel or Becker-Döring-Tunitskii equations. Starting from a phenomenological stochastic differential equation, a unified equation is obtained in this work. In other words, CNT expressions are recovered by selecting one or another stochastic calculus. Moreover, it is shown that the unified CNT thus obtained produces the same Fokker-Planck equation as that from a recent update of CNT [J. F. Lutsko and M. A. Durán-Olivencia, J. Chem. Phys. 138, 244908 (2013)10.1063/1.4811490] when mass transport is governed by diffusion. Finally, we derive a general induction-time expression along with specific approximations of it to be used under different scenarios, in particular, when the mass-transport mechanism is governed by direct impingement, volume diffusion, surface diffusion, or interface transfer.

摘要

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