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The Diffusion Equation Derivation of the Diffusion Equation from the Transport Equation Tissue Optics S t e f a n A n d e r s s o n E n g e l s Approximations The transport equation is difficult to solve analytically. In order to find an analytical solution we need to simplify the problem: äDiscretisation methods N (r , s, t ) = ∑ N (r , si , t ) i ä discrete ordinates method ä 2-flux method or Kubelka-Munk theory ä Adding-double method äExpansion methods ä Diffusion theory äProbabilistic methods ä Monte Carlo simulations © Stefan Andersson-Engels 1 The P N - approximation A formal method of solving a differential equation is to find a solution to its homogenous part and expand the general solution in terms of the homogenous solution obtained. Another approach would be to expand the radiance or photon distribution function in wellknown appropriate function series. This is performed in the diffusion approximation. N ( r , s , t ) = N (r , t ) ∑ ai ( r , t )ψi (s ) i © Stefan Andersson-Engels Diffusion approximation One of the most useful approaches for tissuelight interaction is the diffusion approximation, as it can be solved analytically for simple geometries. The diffusion approximation has been used extensively in photon propagation modelling in tissue in the time domain, as well as in the frequency domain and in the steady state. © Stefan Andersson-Engels 2 Diffusion approximation The basic idea behind the diffusion approximation is to expand the functions in the transport equation into spherical harmonics, and to use only the lowest order in the expansion. Thus the position and directional variables can be separated into new functions. Expanding the distribution function N(r,s,t) yields: ∞ N (r , s , t ) = ∑ +l ∑ l = 0 m =− l 2l + 1 N lm ( r , t )Ylm ( s ) 4π © Stefan Andersson-Engels Spherical harmonics Spherical harmonics do form a complete set of expansion of wave functions. They are frequently used in quantum mechanics since they are eigenfunctions to the angular momentum operators in central force problems. © Stefan Andersson-Engels 3 Spherical harmonics The spherical harmonics form an orthogornal set , since 2π π ∫ ∫ (Y l m (θ , ϕ )) Yl m' ' (θ , ϕ )sin θdθ dϕ = δl ,l 'δm ,m ' ∗ 0 0 © Stefan Andersson-Engels Spherical harmonics Definition: Ylm (θ , ϕ ) = 2 l + 1 ( l − m)! ( − 1) m eimϕ Pl m (cosθ ) 4π ( l + m)! where 2 m/ 2 1 − ζ ( ) P m (ζ ) = l 2l ⋅ l ! d l+ m 2 l ( ζ − 1 ) ; m≤ l l+ m dζ are the associated Legendre polynomials © Stefan Andersson-Engels 4 Spherical harmonics The first few spherical harmonics are: Y00 = 1 4π 3 cos θ 4π 3 ±iϕ Y1±1 = m e sin θ 8π Y10 = © Stefan Andersson-Engels The P 1-approximation Truncating the expansion after the terms would yield N (r , s , t ) = 1 L 00 (r , t ) Y00 (s ) + 4π 3 4π 1 ∑L m =− 1 1m (r , t ) Y1m ( s) This expression could now be inserted into the transport equation, which after integration over s would give four equations and four unknowns. © Stefan Andersson-Engels 5 The vector approach Another approach is to observe that Y 00 is a scalar ± and that Y1m (m=0, ±1) represent the three components of a vector. The expression for the photon distribution function N thus can be substituted by N ( r , s, t ) = A( r , t ) + B (r , t ) ⋅ s where A is the isotropic distribution and B the linear gradient of the photon distribution function, respectively, and s the vector of the gradient. © Stefan Andersson-Engels Arbitrary point in space ä An arbitrary point in space can be expressed as coordinate values for a defined set of $ + yy$ + zz$ base vectors. r = xx ä To have a unique set of coordinates for each point the base vectors need to be orthogonal, i.e. x$ ⋅ y$ = 0 etc. ä For a multidimensional function the base vectors need to be function, but the principle of expansion is otherwise identical © Stefan Andersson-Engels 6 Point versus function Describing a directional function is the same as having an intensity plot over a spherical surface Describing a point in space can be done with 3 co-ordinates © Stefan Andersson-Engels Diffusion: schematically 1 N =a Y + 0 0 0 ∑a m= −1 Y =A + B ⋅s m 1m 1 Assume for the illustration that A = 1, Bx= 0.1, By = Bz = 0 a0 + a10 Y00 = Y10 © Stefan Andersson-Engels 7 Photon density function ρ(r,t) To determine A, this expression is integrated over ω: ρ( r, t ) ≡ ∫ N ( r, s, t )dω = ∫ ( A + s ⋅ B )dω where ρ(r,t) is the photon density. The last term on the right-hand-side is equal to zero. This yields the expression for A: 1 A= ρ(r , t ) 4π © Stefan Andersson-Engels Photon current density To determine B, the expression is first multiplied by s and then integrated over ω: ∫ sN (r , s, t )dω = ∫ s( A + s ⋅ B)dω The left-hand-side is the definition of the photon current density divided by the velocity of light. The first term on the right-hand-side is equal to zero. This yields the expression for B: B= 3 J (r , t ) 4πc © Stefan Andersson-Engels 8 Diffusion approximation Putting the expressions for A and B together yields the angular expansion of N. 1 3 N ( r , s, t ) = ρ ( r , t ) + J ( r , t ) ⋅ s 4π c In a similar way the source function can be expanded and written as. q( r , s, t ) = [ 1 q ( r , t ) + 3q1 (r , t ) ⋅ s 4π 0 ] © Stefan Andersson-Engels Insertion in transport equation This gives: ∂ ∂t 3 3 3 ρ + J ⋅ s = − c s ⋅∇ ρ + J ⋅ s − c µ ( r ) ρ + J ⋅ s + t c c c 3 cµs ( r) ∫ p( s'⋅s) ρ + J ⋅ s ' dω ' + q 0 + 3q1 ⋅ s c 4π The integral can now be solved using ∫4 π p(s, s′ )( s ⋅ s' )dω ' p( s, s′ )dω ' = 1 and g = ∫ p( s, s' )dω ' 4π ∫ 4π © Stefan Andersson-Engels 9 Rearrangements yields The resulting expression is: ∂ρ 3 ∂ ( J ⋅ s) + = c( − s ⋅∇ − µt + µs ) ρ + ∂t c ∂t 3( − s ⋅∇ − µt + gµs ) J ⋅ s + q 0 + 3q1 ⋅ s Rearranging and simplifying this expression, using µtr = (1 − g ) µs + µa = µs ′+ µa yields: 1 ∂ρ 3 ∂ ( J ⋅ s ) 3 + = ( − s ⋅∇ − µ ) ρ + ( − s ⋅ ∇ − µtr ) J ⋅ s + a c ∂t c ∂ t c 1 3 q 0 + q1 ⋅ s c c © Stefan Andersson-Engels The reduced scattering coefficient The reduced scattering coefficient is defined as: µs ' = (1 − g ) µs © Stefan Andersson-Engels 10 Mathematical simplification I Now, if this expression is integrated over ω and use ∫ (s ⋅ A )dω = 0 4π (A ⋅ B) 3 ∫ ( s ⋅ A )( s ⋅ B ) dω = we get: 1 ∂ρ 1 1 = − µa ρ − ∇ ⋅ J + q 0 c ∂t c c (1) If the equation instead first is multiplied by s and then integrated over ω using © Stefan Andersson-Engels Mathematical simplification II ∫ s(s ⋅ A )dω = 4π A 3 ∫ Csdω = 0 we get 1 ∂J 1 1 µtr = − ∇ρ − J + q1 c 2 ∂t 3 c c Here we make some approximations. Assuming that we have an isotropic source, i.e. q1=0, at steady-state, we obtain Fick’s law from this equation: J = −c D ∇ρ © Stefan Andersson-Engels 11 The diffusion coefficient Here we introduce an important definition, the diffusion coefficient: 1 1 D= = 3µtr 3( µa + (1 − g ) µs ) Putting Fick’s law into Eq. (1) we arrive at the final expression, the diffusion equation: 1 ∂ρ 1 − ∇ D ∇ρ + µa ρ = q 0 c ∂t c © Stefan Andersson-Engels The Diffusion Equation! By assuming a homogenous medium, that means that the diffusion coefficient D is constant and using the relation that the fluence rate is related to the photon density by: φ ( r , t ) = chνρ (r , t ) one arrives in the diffusion equation as it is usually presented in the field of biomedical optics: 1∂ φ (r , t ) − D∇ 2φ (r , t ) + µa φ (r , t ) = S (r , t ) c ∂t © Stefan Andersson-Engels 12 Diffusion approximation validity The diffusion equation is valid only if the propagating light is diffuse and this implies that the reduced scattering coefficient is much larger than the absorption, i.e. (1-g)µs>>µa. The source and detector must also be separated in space and time to allow that the light is diffuse when it reaches the detector. © Stefan Andersson-Engels Point source solution The solution to the diffusion equation for an infinite homogenous slab with a short pulse isotropic point source S ( r , t ) = δ ( 0,0) is φ( r , t ) = c( 4πDct ) − 3/ 2 r2 exp( − − µa ct ) 4 Dct This Green’s function can be used to solve problems for a slightly more complex geometry. © Stefan Andersson-Engels 13