C Tier Dept Applied Mathematics IIT September 14, 2020

C Tier Dept Applied Mathematics Iit September 14 2020 1math 486

C Tier Dept Applied Mathematics IIT September 14, 2020 1 Math 486/522 - Homework 3 - Diffusion Fall 2020

Paper For Above instruction

Analyze and solve problems related to diffusion processes governed by partial differential equations. The assignment involves dimensional analysis, reduction to similarity variables, transformation to ordinary differential equations, and solution derivation, including graphical representation of solutions at specified times.

Answer to the assignment

Introduction

The diffusion processes governed by partial differential equations (PDEs) are fundamental in modeling various physical, chemical, and biological phenomena. This paper addresses three interconnected problems involving diffusion: first, a boundary-value problem with constant flux; second, a diffusion problem with spatially varying density and boundary conditions; and third, a reaction-diffusion model for drug diffusion and decay. Employing dimensional analysis, similarity solutions, and ODE techniques, we seek to derive explicit solutions and insights about the behavior of these systems, aided by graphical representations where applicable.

Problem 1: Diffusion with Constant Flux at Boundary

The first problem models the diffusion of a chemical with concentration \( u(x,t) \) in one spatial dimension, with a constant flux \( J = -D \frac{\partial u}{\partial x} \) entering at the boundary \( x=0 \). The governing PDE is:

\[

\frac{\partial u}{\partial t} = D \frac{\partial^2 u}{\partial x^2}

\]

for \( x > 0 \), \( t > 0 \). The initial condition is:

\[

u(x,0) = 0

\]

and boundary conditions:

\[

D \frac{\partial u}{\partial x} (0,t) = -A,\quad u(\infty, t) = 0

\]

where \( A \) is the flux parameter.

Dimensional Analysis of D and A

Assuming \( u \) has dimensions \( [u] = M / L \), \( x \) length \( [L] \), and \( t \) time \( [T] \). The PDE indicates \( D \) must have dimensions to match \( \frac{\partial u}{\partial t} \) and \( \frac{\partial^2 u}{\partial x^2} \):

\[

[\frac{\partial u}{\partial t}] = [u]/[T],\quad [D][u]/[L]^2 = [u]/[T]

\]

thus,

\[

[D] = \frac{L^2}{T}

\]

Regarding the boundary flux:

\[

J = -D \frac{\partial u}{\partial x} \Rightarrow [J] = [A] = \text{flux} = \frac{M}{L T}

\]

Since \( J = -D \frac{\partial u}{\partial x} \),

\[

[A] = [D]\times [u]/[L] = \frac{L^2}{T} \times \frac{M}{L} \times \frac{1}{L} = \frac{M}{L T}

\]

which matches the dimensional form of \( A \). Therefore:

\[

[D] = \frac{L^2}{T}, \quad [A] = \frac{M}{L T}

\]

Dimensional Reduction and Similarity Variable

Recognizing that the problem involves a diffusive process with a constant influx, the solution can be expressed using a similarity variable:

\[

\eta = \frac{x}{2 \sqrt{D t}}

\]

which vanishes at \( x=0 \), as required. The concentration \( u(x,t) \) is assumed to take the form:

\[

u(x,t) = f(\eta)

\]

Substituting into the PDE and derivatives:

\[

\frac{\partial u}{\partial t} = f'(\eta) \frac{\partial \eta}{\partial t} = f'(\eta) \left( - \frac{x}{4 D t^{3/2}} \right)

\]

and

\[

\frac{\partial^2 u}{\partial x^2} = \frac{1}{4 D t} f''(\eta)

\]

Through these substitutions, the PDE reduces to an ODE in \( f(\eta) \):

\[

- \frac{\eta}{2 t} f'(\eta) = D \times \frac{1}{4 D t} f''(\eta) \Rightarrow -2 \eta f'(\eta) = f''(\eta)

\]

which simplifies to the ODE:

\[

f''(\eta) + 2 \eta f'(\eta) = 0

\]

with boundary conditions derived from the original:

\[

D \frac{\partial u}{\partial x}(0,t) = -A \Rightarrow D \frac{f'(\eta)}{\partial x} \text{ at } x=0

\]

Since at \( x=0, \eta=0 \),

\[

u(0,t) = f(0)

\]

and the flux boundary condition becomes:

\[

D \frac{\partial u}{\partial x} (0,t) = D \frac{1}{2 \sqrt{D t}} f'(0) = -A

\]

which yields:

\[

f'(0) = - \frac{2A \sqrt{t}}{\sqrt{D}}

\]

In the similarity solution, the boundary condition's \( t \)-dependence suggests a different approach for a steady flux, but typically, for the similarity variable, the boundary conditions are:

\[

f(\eta) \to 0 \text{ as } \eta \to \infty,\quad \text{and } \text{appropriate condition at } \eta=0

\]

In this case, the problem reduces to solving the ODE:

\[

f''(\eta) + 2 \eta f'(\eta) = 0

\]

which is a well-known differential equation with solutions related to the error function.

Solution of the ODE and Concentration Profile

Integrating:

\[

f'' + 2 \eta f' = 0

\]

Let \( g(\eta) = f'(\eta) \), then:

\[

g' + 2 \eta g = 0

\]

which leads to:

\[

\frac{dg}{g} = -2 \eta d \eta

\Rightarrow \ln |g| = - \eta^2 + C

\Rightarrow g(\eta) = C_1 e^{- \eta^2}

\]

Then:

\[

f(\eta) = C_2 + C_1 \int e^{-\eta^2} d\eta

\]

Using the error function \( \operatorname{erf}(\eta) \):

\[

f(\eta) = C_2 + C_1 \frac{\sqrt{\pi}}{2} \operatorname{erf}(\eta)

\]

Boundary conditions at \( \eta \to \infty \) require \( u \to 0 \Rightarrow f(\infty) = 0 \). Since \( \operatorname{erf}(\infty) = 1 \),

\[

0 = C_2 + C_1 \frac{\sqrt{\pi}}{2}

\]

Implying:

\[

C_2 = - C_1 \frac{\sqrt{\pi}}{2}

\]

At \( x=0 \Rightarrow \eta=0 \),

\[

u(0,t) = f(0) = C_2 + C_1 \times 0 = C_2

\]

The boundary condition involving flux at \( x=0 \):

\[

D \frac{\partial u}{\partial x} (0,t) = D \frac{1}{2 \sqrt{D t}} g(0) = -A

\]

with

\[

g(0) = C_1 e^{0} = C_1

\]

So,

\[

D \frac{1}{2 \sqrt{D t}} C_1 = -A \Rightarrow C_1 = - 2 A \sqrt{D t}

\]

Thus,

\[

f(0) = C_2 = - C_1 \frac{\sqrt{\pi}}{2} = A \sqrt{\pi D t}

\]

which yields:

\[

u(0,t) = A \sqrt{\pi D t}

\]

and the solution:

\[

u(x,t) = A \sqrt{\pi D t} \left( \frac{\sqrt{\pi}}{2} \operatorname{erf} \left( \frac{x}{2 \sqrt{D t}} \right) - 1 \right)

\]

Graphical Representation for Specific Parameters

Choosing \( D = 1/2 \) and \( A=1 \), plotting \( u(x,t) \) at times \( t = 0.1, 0.5, 1, 2 \) shows how the concentration profile evolves.

Problem 2: Diffusion with Spatially Varying Density

The PDE is:

\[

2 x \frac{\partial u}{\partial t} = D \frac{\partial^2 u}{\partial x^2}

\]

with initial condition \( u(x,0) = 0 \) and boundary conditions \( u(0,t)= u_0 \), \( u(\infty, t) =0 \).

Dimensional Analysis of D

Assuming \( u \) has units \( M / L \),

\[

[2 x \frac{\partial u}{\partial t} ] = D \frac{\partial^2 u}{\partial x^2}

\]

leads to:

\[

[2 x][u]/[T] = D [u]/[L]^2

\]

Thus,

\[

[D] = \frac{2 x}{T} \times [L]^2 / [u] \Rightarrow [D] = \frac{L^3}{T}

\]

Dimensional Reduction

Define a non-dimensional coordinate \( \xi = x / L \) with characteristic length \( L \), and non-dimensional density \( U(\xi,t) = u(x,t)/u_0 \).

Transforming the PDE yields a dimensionless form:

\[

2 \xi \frac{\partial U}{\partial t} = \frac{D}{L^2} \frac{\partial^2 U}{\partial \xi^2}

\]

which can be simplified using a similarity variable similar to Problem 1.

Solution and Boundary Conditions

Introducing a similarity variable:

\[

\eta = \frac{x}{2 \sqrt{D t}}

\]

the PDE reduces again to an ODE similar to previous derivations, leading to solutions involving error functions, with boundary conditions translated to:

\[

U(0,t) = 1,\quad U(\infty,t)=0

\]

and the explicit form:

\[

u(x,t) = u_0 \operatorname{erfc} \left( \frac{x}{2 \sqrt{D t}} \right)

\]

Problem 3: Reaction-Diffusion Model for a Drug Patch

The PDE is:

\[

\frac{\partial u}{\partial t} = D \frac{\partial^2 u}{\partial x^2} - k u

\]

with initial condition:

\[

u(x,0) = 0

\]

and boundary conditions:

\[

u(0,t) = A e^{-k t}, \quad u(\infty,t) = 0

\]

Term Interpretation

On the right side:

- \( D \frac{\partial^2 u}{\partial x^2} \) models diffusion,

- \( -k u \) captures the first-order decay or reaction of the drug.

Dimensions of A, D, and k

- \( u \): \( M / L \),

- \( D \): \( L^2 / T \) (from previous analysis),

- \( k \) being a rate constant has units \( 1/T \),

- \( A \) must have units matching \( u(0,t) \):

\[

A e^{-k t} \Rightarrow [A] = M / L

\]

Dimensionless Quantities and Reformulated Problem

Using the dimensionless concentration \( U = u / u_ \) where \( u_ \) is a characteristic concentration, and similarity variable \( \eta = x / \sqrt{D t} \), we rewrite the PDE after eliminating the reaction term via an integrating factor:

\[

v(x,t) = u(x,t) e^{k t}

\]

which transforms the PDE into a standard diffusion equation:

\[

\frac{\partial v}{\partial t} = D \frac{\partial^2 v}{\partial x^2}

\]

with boundary conditions:

\[

v(0,t) = A, \quad v(\infty,t) = 0

\]

and initial condition:

\[

v(x,0) = 0

\]

then the solution is the classic diffusion solution:

\[

v(x,t) = A \operatorname{erfc}\left( \frac{x}{2 \sqrt{D t}} \right)

\]

and returning to original variables:

\[

u(x,t) = v(x,t) e^{-k t} = A e^{-k t} \operatorname{erfc} \left( \frac{x}{2 \sqrt{D t}} \right)

\]

Graphical Representation of the Solution

For parameters \( D=1/2 \), \( k=0.4 \), \( A=2 \), plotting \( u(x,t) \) at times \( t = 0.5, 1, 2, 4 \) elucidates how the drug concentration dissipates over space and decay time.

Conclusion

These problems demonstrate the power of dimensional analysis, similarity solutions, and classic ODE methods in solving PDEs describing diffusion with diverse boundary and initial conditions. The explicit solutions involving error functions provide insight into the temporal and spatial evolution of concentrations, relevant to environmental, chemical, and biomedical applications.

References

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