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Upscaling and effective properties in saturated zone
transport
Wolfgang Kinzelbach
IHW, ETH Zürich
Contents
• Why do we need upscaling
• Methods
• Examples where we have been successful
• When does upscaling not work
• Conclusions
Dilemma in Hydrology
• Point-like process information available• Regional statement required• Point-like information is highly variable and
stochastic• Solutions to inverse problem are non-unique• Predictions based on non-unique model are
doubtful
Multiscale processes
• Turbulence
• Catchment hydrology
• Flow and transport in porous media
Possibilities for going from one scale to another
• Same law – different parameter– Diffusion-Dispersion– Average transmissivity
• Different law– Molecular dynamics-Gas law– Fractal geometries– Radioactive decay of mixture of radionuclides
• No general law for larger scale– Singular features, non-linear processes– Small cause - big effect situations
Common Problem
• Few coefficients for summing up complex subscale processes
• No clear separation of scales
• Way out: scale dependent coefficients
Effective parameters in transport
• Ensemble mixing versus real mixing
homogen heterogen
Grossskalige Heterogenität
Heterogeneity and effective parameters
Cutoff
Small scale
Details unknown
Stochastic
Repetitive
Modelled implicitlyby parametrization
Large scale
Explicitly known
Deterministic
Singular features
Modelledexplicitly byflowfield
Differential advection
Only after a long distance (asymptotic regime)Equivalent to a diffusive process called dispersion
After a shorter distance (preasymptotic)equivalent to a dual-porous medium
mobile
immobile
Hint for practical work: After design on the assumption of homogeneity,test your design with a set of randomly generated media
An ideally designed dipole may possibly look like that:
A robust design would be the one which survives a large majority of a class of realistic random samples
Ways out
• New sources of conditioning information for some processes: airborne geophysics, remote sensing from satellite of airplane platforms, environmental tracers
• Simulation of small scale and Monte Carlo
• Back to much simpler conceptual models
• Computations only with error estimate
Model Concepts
Quantification of the impact of Uncertainty
Main interest on large observational scales
How to cope with parameter uncertainty ?
Stochastic Modelling Large Scale Modelling
Stochastic Modelling Approach
500 1000 1500
x_1 [m ]
200
700
1200
x_2
[m]
Stauffer et al., WRR, 2002
Different realizations of a catchment zone
Risk Assessment (question 3)
Large Scale ModellingLarge Scale Predictions
• Model on a „regional“ scale : 50 „small“ scale lengths• Resolution : „small“ scale length/5
• Number of unknowns
00062515550 3 .. d
HomogenizationLarge Scale Flow Models with effective conductivity
fine
grid
mod
el large grid m
odel
0 )()(~ xxKK 000 )(xK
K x( )
0K
Homogenization
Homogenization Theory Volume averaging Ensemble Averaging (if system ergodic)
= Asymptotic theory (scale separation between observation scale and heterogeneity scale)
l L0
lL
HomogenizationLarge Scale Transport with effective (advection-enhanced) dispersion
00 0 0 0 0tc x t u c x t D c x t( , ) ( , ) ( , )
fine
grid
mod
el large grid m
odel
Limitations of Homogenization
Problems where the scale of heterogeneities
is not well separated from
• Observation scale:
• Process scale: velocity gradients, concentration gradients, mixing length scale
0l
Lobs
l L Lpr obs
Limitations of HomogenizationNatural Media = Multiscale Media with Scale Interactions,
(no scale separation)
1l 2l 3l1
12
0ll
22
3
0ll
Limitations of Homogenization
After Schulze-Makuch et al., GW, 1999
Question: How to model scale interactions
(continuum of scales) ?
pre-asymptotic
system
with scale dependent parameters
Limitations of Homogenization
Question: How to avoid artificial averaging effects?
process scale
1. by flow geometry
2. by mixing length scale (transient)
3. by concentration fronts
l LLpr obs
Multiscale ModellingImproved Approach: accounts for pre-asymptotic effects
Coarse Graining (Filter) Methods
fine
grid
mod
el coarse grid m
odel
0 )()(~ xxKK 0
)()(~)(eff xxKK
l L
Multiscale Modelling: Theory
Idea:
Spatial filter over all length scales smaller than cut –off length scale
λ
)()( yxfydxf d
d
2
1
Attinger, J. Comp. GeoSciences,20031kf k( )
Equivalent in Fourier Space to
Multiscale Modelling: Flow
Fine scale flow model
Filtered flow model
0 )()(~ xxKK
0 )()(~)(eff xxKK
Multiscale Modelling: Flow
Scale dependent mean conductivity
(subscale effects)
D=2:
D=3:
)exp()(eff22
22
2
1
l
lKK fg
)exp()(/
eff
23
22
222
3
1
6
1
l
lKK ffg
Attinger, J. Comp. GeoSciences,2003
Multiscale Modelling: Flow
Statistical properties of the filtered conductivity fields
2
2222
1
1/
/
d
ff l
21221/
/ lll
Multiscale Modelling: Transport
0t c x t u x c x t D t c x teff( , ) ( ) ( , ) ( , ) ( , )
Fine scale transport model
Filtered transport model
0tc x t u x c x t D c x t( , ) ( ) ( , ) ( , )
Multiscale Modelling: Transport
211 11 1 22
2
11
1Hf d
T
t l
l
macro( )/( , )
Scale dependent macro dispersivities:
real dispersivities plus artificial mixing (centre-of-mass
fluctuations)
Multiscale Modelling: Transport
11 11 11
211 11 1 2
2
211 1 2 1 2
2
2 22
114
1
1 114
11
f dT
f d dT
t t t
t lD tl
t lD t
ll
eff eff eff
eff( )/
eff( )/ ( )/
( , ) ,
( )
,
Scale dependent real dispersivities
Model with real dilution
Model with artificial dilution
Transport Codes
1/2
2V
T
1/2
2H
T
H2f
011
eff11
l
t4D1
l
t4D1
11lσα(t)α
VH
Multiscale Modelling: Transport
Reactive Fronts
Travelling fronts• Introduction of generalised spatial moment analysis
(Attinger et al., MMS, 2003)
cDcxuckc ptdt 1
Reactive Fronts
Fin
e s
cale
mo
del L
arge
scale
Mo
del
'''' xcxxDxdcuckc dptdt 01
Travel time differences lead to artificial mixing by Large Scale Filtering
Reactive Fronts
Fin
e s
cale
mo
del L
arge
scale
Mo
del
cDcuckc ptdt eff01
Local Mixing = Real Mixing
Reactive Fronts
Travel time differences
=nonlocal macrodispersive flux
Real mixing
= local real dispersive flux
Attinger et al., MMS, 2003Dimitrova et al., AWR, 2003