• Title/Summary/Keyword: reaction-diffusion equation

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Analytical Solutions of Unsteady Reaction-Diffusion Equation with Time-Dependent Boundary Conditions for Porous Particles

  • Cho, Young-Sang
    • Korean Chemical Engineering Research
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    • v.57 no.5
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    • pp.652-665
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    • 2019
  • Analytical solutions of the reactant concentration inside porous spherical catalytic particles were obtained from unsteady reaction-diffusion equation by applying eigenfunction expansion method. Various surface concentrations as exponentially decaying or oscillating function were considered as boundary conditions to solve the unsteady partial differential equation as a function of radial distance and time. Dirac delta function was also used for the instantaneous injection of the reactant as the surface boundary condition to calculate average reactant concentration inside the particles as a function of time by Laplace transform. Besides spherical morphology, other geometries of particles, such as cylinder or slab, were considered to obtain the solution of the reaction-diffusion equation, and the results were compared with the solution in spherical coordinate. The concentration inside the particles based on calculation was compared with the bulk concentration of the reactant molecules measured by photocatalytic decomposition as a function of time.

Modeling of diffusion-reaction behavior of sulfate ion in concrete under sulfate environments

  • Zuo, Xiao-Bao;Sun, Wei;Li, Hua;Zhao, Yu-Kui
    • Computers and Concrete
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    • v.10 no.1
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    • pp.79-93
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    • 2012
  • This paper estimates theoretically the diffusion-reaction behaviour of sulfate ion in concrete caused by environmental sulfate attack. Based on Fick's second law and chemical reaction kinetics, a nonlinear and nonsteady diffusion-reaction equation of sulfate ion in concrete, in which the variable diffusion coefficient and the chemical reactions depleting sulfate ion concentration in concrete are considered, is proposed. The finite difference method is utilized to solve the diffusion-reaction equation of sulfate ion in concrete, and then it is used to simulate the diffusion-reaction process and the concentration distribution of sulfate ion in concrete. Afterwards, the experiments for measuring the sulfate ion concentration in concrete are carried out by using EDTA method to verify the proposal model, and results show that the proposed model is basically in agreement with the experimental results. Finally, Numerical example has been completed to investigate the diffusion-reaction behavior of sulfate ion in the concrete plate specimen immersed into sulfate solution.

EXISTENCE OF RANDOM ATTRACTORS FOR STOCHASTIC NON-AUTONOMOUS REACTION-DIFFUSION EQUATION WITH MULTIPLICATIVE NOISE ON ℝn

  • Mosa, Fadlallah Mustafa;Ma, Qiaozhen;Bakhet, Mohamed Y.A.
    • Korean Journal of Mathematics
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    • v.26 no.4
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    • pp.583-599
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    • 2018
  • In this paper, we are concerned with the existence of random dynamics for stochastic non-autonomous reaction-diffusion equations driven by a Wiener-type multiplicative noise defined on the unbounded domains.

WAVEFRONT SOLUTIONS IN THE DIFFUSIVE NICHOLSON'S BLOWFLIES EQUATION WITH NONLOCAL DELAY

  • Zhang, Cun-Hua
    • Journal of applied mathematics & informatics
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    • v.28 no.1_2
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    • pp.49-58
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    • 2010
  • In the present article we consider the diffusive Nicholson's blowflies equation with nonlocal delay incorporated into an integral convolution over all the past time and the whole infinite spatial domain $\mathbb{R}$. When the kernel function takes a special function, we construct a pair of lower and upper solutions of the corresponding travelling wave equation and obtain the existence of travelling fronts according to the existence result of travelling wave front solutions for reaction diffusion systems with nonlocal delays developed by Wang, Li and Ruan (J. Differential Equations, 222(2006), 185-232).

APPLICATION OF HP-DISCONTINUOUS GALERKIN FINITE ELEMENT METHODS TO THE ROTATING DISK ELECTRODE PROBLEMS IN ELECTROCHEMISTRY

  • Okuonghae Daniel
    • Journal of applied mathematics & informatics
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    • v.22 no.1_2
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    • pp.1-20
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    • 2006
  • This paper presents the interior penalty discontinuous Galerkin finite element methods (DGFEM) for solving the rotating disk electrode problems in electrochemistry. We present results for the simple E reaction mechanism (convection-diffusion equations), the EC' reaction mechanism (reaction-convection-diffusion equation) and the ECE and $EC_2E$ reaction mechanisms (linear and nonlinear systems of reaction-convection-diffusion equations, respectively). All problems will be in one dimension.

Application of Reaction Path Smoluchowski Equation Formalism to the Photoisomerization of Trans-Stilbene

  • Kim, Dong-Sup;Lee, Sang-Youb
    • Bulletin of the Korean Chemical Society
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    • v.12 no.6
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    • pp.692-698
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    • 1991
  • The reaction path Smoluchowski equation approach developed in a recent work to calculate the rate constant for a diffusive multidimensional barrier crossing process is extended to incorporate the configuration-dependent diffusion matrix. The resulting formalism is then applied to the investigation of stilbene photoisomerization dynamics. Adapting a model two-dimensional potential and a model diffusion matrix proposed by Agmon and Kosloff [J. Phys. Chem.,91 (1987) 1988], we derive an eigenvalue equlation for the relaxation rate constant of the stilbene photoisomerization. This eigenvalue equation is solved numerically by using the finite element method. The advantages and limitations of the present method are discussed.

A SCHWARZ METHOD FOR FOURTH-ORDER SINGULARLY PERTURBED REACTION-DIFFUSION PROBLEM WITH DISCONTINUOUS SOURCE TERM

  • CHANDR, M.;SHANTHI, V.
    • Journal of applied mathematics & informatics
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    • v.34 no.5_6
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    • pp.495-508
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    • 2016
  • A singularly perturbed reaction-diffusion fourth-order ordinary differential equation(ODE) with discontinuous source term is considered. Due to the discontinuity, interior layers also exist. The considered problem is converted into a system of weakly coupled system of two second-order ODEs, one without parameter and another with parameter ε multiplying highest derivatives and suitable boundary conditions. In this paper a computational method for solving this system is presented. A zero-order asymptotic approximation expansion is applied in the second equation. Then, the resulting equation is solved by the numerical method which is constructed. This involves non-overlapping Schwarz method using Shishkin mesh. The computation shows quick convergence and results presented numerically support the theoretical results.

PROPERTIES OF POSITIVE SOLUTIONS FOR A NONLOCAL REACTION-DIFFUSION EQUATION WITH NONLOCAL NONLINEAR BOUNDARY CONDITION

  • Mu, Chunlai;Liu, Dengming;Zhou, Shouming
    • Journal of the Korean Mathematical Society
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    • v.47 no.6
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    • pp.1317-1328
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    • 2010
  • In this paper, we study the properties of positive solutions for the reaction-diffusion equation $u_t$ = $\Delta_u+{\int}_\Omega u^pdx-ku^q$ in $\Omega\times(0,T)$ with nonlocal nonlinear boundary condition u (x, t) = ${\int}_{\Omega}f(x,y)u^l(y,t)dy$ $\partial\Omega\times(0,T)$ and nonnegative initial data $u_0$ (x), where p, q, k, l > 0. Some conditions for the existence and nonexistence of global positive solutions are given.

Comparison of Alternate Approaches for Reversible Geminate Recombination

  • Khokhlova, Svetlana S.;Agmon, Noam
    • Bulletin of the Korean Chemical Society
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    • v.33 no.3
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    • pp.1020-1028
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    • 2012
  • This work compares various models for geminate reversible diffusion influenced reactions. The commonly utilized contact reactivity model (an extension of the Collins-Kimball radiation boundary condition) is augmented here by a volume reactivity model, which extends the celebrated Feynman-Kac equation for irreversible depletion within a reaction sphere. We obtain the exact analytic solution in Laplace space for an initially bound pair, which can dissociate, diffuse or undergo "sticky" recombination. We show that the same expression for the binding probability holds also for "mixed" reaction products. Two different derivations are pursued, yielding seemingly different expressions, which nevertheless coincide numerically. These binding probabilities and their Laplace transforms are compared graphically with those from the contact reactivity model and a previously suggested coarse grained approximation. Mathematically, all these Laplace transforms conform to a single generic equation, in which different reactionless Green's functions, g(s), are incorporated. In most of parameter space the sensitivity to g(s) is not large, so that the binding probabilities for the volume and contact reactivity models are rather similar.