Modellering af optagelse af organiske stoffer i grøntsager og frugt

Bilag G
Jury-Model for Transport in Soil

The following 2nd order differentialequation describes the transport of substances in the soil, accounting for both the diffusion in the air and water phases and the advection. Both the effectiv diffusionscoefficient (DE) and the advective flow velocity (VE) are assumed to be constant:

Equation 34

where

CT is the total concentration in soil (mg/kg)
µ is the degradation rate constant for the degradation in soil (d-1).
DE is the effective diffusioncoefficient in soil (m2/d), accounting for both the diffusion in the soil pore water and pore air.
VE is the advective flow velocity of water in the soil (m/d)


The solution of Jury et al. is used (1983, beware! there is an error in equation 24 in this paper, see erratum 1987). This solution includes diffusion in the gas and water phase, advection of water, degradation of the compound and an unpolluted layer on top of the polluted soil layer. As upper boundary condition, concentration at the soil surface is zero. The sensitivity of this model has been studied by Anderson & Parker (1990). The model has already been used in risk assessment by Sanders & Stern (1994). For the simulation of a layer of uncontaminated soil on a layer of contaminated soil (or groundwater), a suitable solution is found in Jury et al. (1990), eqs. 17-21. Of the three times, the equation was typesetted in journals, only one version (erratum 1987) is correct! We therefore use a hand-corrected scan of the solution (from Jury et al. 1990):

The concentration in calculated from:

Equation 35

 

Equation 36

For the initial and boundary conditions

Equation 37

the solution is found by superposition:

Equation 38

where

z is the depth below soil (negative)
t is the time
CT(z,t) is the total concentration in the soil at depth z and time t
JS(0,t) is the volatilization flux at the soil surface and time t
L is depth of the coverage layer
W is the depth of the polluted layer
µ is the 1st order degradation rate constant in soil
HE is calculated from

 

Equation 39

 

DA,Luft is the effective diffusion coefficient in the air
d Luft is thickness of the stagnant layer
VE is calculated from

 

Equation 40

JW    is the volumetric soil water flux (m/d)

Example

Figure G.1 shows the result of a simulation for naphthalene with an initially contaminated layer between -0.5 and -3 m depth, and a non-contaminated soil above. The averaged concentration after 10 years in the originally unpolluted layer between 0 and -50 cm is 12.38% of the initially polluted layer.

Figure G.1
Simulated migration of Naphthalene from a polluted soil layer into a unpolluted cover of thickness 50 cm (Soil 1).

Persistent volatile chemicals migrate with time into the uncontaminated layer. To consider this in plant uptake modelling, the average concentration in the root zone is calculated with the Jury model, and used as factor. The soil concentration relevant for the plant is then the concentration of the chemical in the contaminant layer times the migration factor.

Table G.1
Factors for migration of compounds into uncontaminated soil (ratio between average concentration in upper layer and the concentration in the initial polluted layer). Root zone thickness here set to 0.5 m.

Compound

Soil 1
0-50 cm
1 year

Soil 1
0-50 cm
10 years

Soil 2
0-50 cm
1 year

Soil 2
0-50 cm
10years

Naphthalene

0.039

0.124

0.218

0.053

Benzo(a)pyrene

0.000

0.000

0.000

0.003

MTBE

0.219

0.174

0.057

0.003

Toluene

0.223

0.169

0.011

0.000

n-Dodecane

0.230

0.069

0.002

0.000

Trichloroethene

0.208

0.186

0.014

0.001

Benzene

0.233

0.076

0.004

0.000

Tetrachlorethene

0.242

0.104

0.005

0.000


All chemicals have –except benzo(a)pyrene - the potential to migrate from a deeper polluted layer into a overlying non-polluted layer. The results in Table G.1 show that the average concentration in the root zone is about a factor 5 below that of the initially polluted layer after 1 year. The volatile chemicals, MTBE, toluene, trichloroethene, benzene, tetrachloroethene and n-dodecane, reach their maximum in soil 2 before the first year, and the upper part of the polluted layer depletes quickly. Toluene is known to be degraded quickly in aerobic soils (Rippen 2002), therefore, the value is an upper estimate.