Mathematical models of diffusive transport underpin our understanding of chemical, biochemical, and biological transport phenomena. Analysis of such models often focuses on relatively simple geometries and deals with diffusion through highly idealized homogeneous media. In contrast, practical applications of diffusive transport theory inevitably involve dealing with more complicated geometries as well as dealing with heterogeneous media. One of the most fundamental properties of diffusive transport is the concept of mean particle lifetime or mean exit time, which are particular applications of the concept of first passage time and provide the mean time required for a diffusing particle to reach an absorbing boundary. Most formal analysis of mean particle lifetime applies to relatively simple geometries, often with homogeneous (spatially invariant) material properties. In this work, we present a general framework that provides exact mathematical insight into the mean particle lifetime, and higher moments of particle lifetime, for point particles diffusing in heterogeneous discs and spheres with radial symmetry. Our analysis applies to geometries with an arbitrary number and arrangement of distinct layers, where transport in each layer is characterized by a distinct diffusivity. We obtain exact closed-form expressions for the mean particle lifetime for a diffusing particle released at an arbitrary location, and we generalize these results to give exact, closed-form expressions for any higher-order moment of particle lifetime for a range of different boundary conditions. Finally, using these results, we construct new homogenization formulas that provide an accurate simplified description of diffusion through heterogeneous discs and spheres.
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21 August 2020
Research Article|
August 21 2020
Diffusion in heterogeneous discs and spheres: New closed-form expressions for exit times and homogenization formulas Available to Purchase
Elliot J. Carr
;
Elliot J. Carr
a)
School of Mathematical Sciences, Queensland University of Technology
, Brisbane, Australia
a)Author to whom correspondence should be addressed: [email protected]
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Jacob M. Ryan;
Jacob M. Ryan
School of Mathematical Sciences, Queensland University of Technology
, Brisbane, Australia
Search for other works by this author on:
Matthew J. Simpson
Matthew J. Simpson
School of Mathematical Sciences, Queensland University of Technology
, Brisbane, Australia
Search for other works by this author on:
Elliot J. Carr
a)
School of Mathematical Sciences, Queensland University of Technology
, Brisbane, Australia
Jacob M. Ryan
School of Mathematical Sciences, Queensland University of Technology
, Brisbane, Australia
Matthew J. Simpson
School of Mathematical Sciences, Queensland University of Technology
, Brisbane, Australia
a)Author to whom correspondence should be addressed: [email protected]
J. Chem. Phys. 153, 074115 (2020)
Article history
Received:
April 16 2020
Accepted:
July 30 2020
Citation
Elliot J. Carr, Jacob M. Ryan, Matthew J. Simpson; Diffusion in heterogeneous discs and spheres: New closed-form expressions for exit times and homogenization formulas. J. Chem. Phys. 21 August 2020; 153 (7): 074115. https://doi.org/10.1063/5.0010810
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