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2. ENVIRONMENTAL ChEMISTRy & TEChNOLOGy 2.1. Lectures

2. ENVIRONMENTAL ChEMISTRy & TEChNOLOGy 2.1. Lectures

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Chem. Listy, 102, s265–s1311 (2008) Environmental Chemistry & Technology<br />

2<br />

∂C<br />

∂ C<br />

ux = Dy<br />

2 z<br />

∂x<br />

∂y<br />

( x)<br />

+ D ( x)<br />

2<br />

∂ C ∂C<br />

+ W 2<br />

∂z<br />

∂z<br />

Here u x is a wind speed in the x direction; all other variables<br />

are the same as in equation (2).<br />

To be completed, the PDE (3) needs to have specified<br />

boundary conditions. The first condition follows from an assumption<br />

of continuous point source with constant strength<br />

located in (0,0,h) coordinates:<br />

The next two conditions follow from the natural assumption<br />

that pollutant concentration approaches zero far from the<br />

source in the lateral y directions and high above the source:<br />

( )<br />

(3)<br />

C x, +∞ , z = 0 .<br />

(3b)<br />

( )<br />

C x, −∞ , z = 0 .<br />

(3c)<br />

C( x, y , +∞ ) = 0 .<br />

(3d)<br />

The last boundary condition is that pollutant deposition<br />

onto the ground occurs at a rate proportional to local air<br />

concentration 3 (for simplicity, the flat ground is taken into<br />

account only):<br />

⎡ ∂C<br />

⎤<br />

⎢<br />

D W C<br />

⎥<br />

vC<br />

⎣ ⎦<br />

( ∞ ) + = [ ] = 0<br />

z z<br />

∂z<br />

z=<br />

0<br />

.<br />

(3a)<br />

(3e)<br />

The deposition velocity v depends on many factors such<br />

as type and size of pollutant particles, the roughness of terrain<br />

and its other surface properties and the meteorological<br />

conditions.<br />

A n a l y t i c a l m o d e l<br />

The analytical solution of equation (3) with respect to<br />

boundary conditions (3a-e) is derived in (refs. 3,5,6 ), and it is<br />

done by expression (4):<br />

(4)<br />

s387<br />

The standard deviations of plume width and height, σ y<br />

and σ z , are defined in terms of their respective diffusion coefficients<br />

3,6 :<br />

The error function erfc (ξ) is defined in (ref. 4 ) as:<br />

n u m e r i c a l M o d e l<br />

In our model we have decided to use the well know<br />

method of lines, which was frequently used for solving different<br />

kinds of PDEs by classical analog and hybrid computers.<br />

In order to perform this method the given PDE (3) must be<br />

transformed into the system of ordinary differential equations<br />

(ODEs). To do that the discretization of all variables except<br />

one must be done. In our case we have discretized y (points<br />

j, step Δy) and z (points k, step Δz) variables and we have<br />

let the x variable continuous (because of the assumed wind<br />

direction).<br />

The obtained system of ODEs is as follows:<br />

( , , )<br />

dC x j k<br />

∂x<br />

=<br />

( ) ( , + 1, ) − 2 ( , , ) + ( , −1,<br />

)<br />

Dy x C x j k C x j k C x j k<br />

⋅ +<br />

u y<br />

2<br />

x<br />

∆<br />

( ) ( , , + 1) − 2 ( , , ) + ( , , −1)<br />

D x C x j k C x j k C x j k<br />

+<br />

z<br />

⋅ +<br />

u z<br />

2<br />

x<br />

∆<br />

( , , + 1 ) − ( , , −1)<br />

.<br />

W C x j k C x j k<br />

+ ⋅<br />

ux 2∆z<br />

The system of ODEs (6) is solved inside the <br />

interval along the y direction, and inside the along the<br />

z direction, where N j and N k are natural numbers. Thus the<br />

total number of ODEs is (2N j + 1) × (N k + 1) and all equations<br />

can be solved for current time point in parallel.<br />

The boundary condition (3a) is transformed to new initial<br />

conditions (7a):<br />

C<br />

C<br />

( 0,<br />

0,<br />

H )<br />

Q<br />

=<br />

u ∆y∆z<br />

x<br />

( 0,<br />

j,<br />

k)<br />

= 0 otherwise .<br />

(7)<br />

(7a)<br />

And new boundary conditions (7b–e) for the ODEs system<br />

(7) with respect to (3b–e) are:<br />

(5)<br />

(6)

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