daycent-chem overview melannie hartman nrel cans project meeting feb. 15-17, 2006 sylvan dale ranch...
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DayCent-Chem Overview
Melannie HartmanNREL
CANS Project MeetingFeb. 15-17, 2006Sylvan Dale Ranch
Loveland, CO
John Fielder
SO2
NOx
Why was DayCent-Chem developed?
• Biological cycling of nutrients is important to predicting deposition effects on stream/soil chemistry.
• Management of forests, croplands, and grasslands built into Century.
• Daily time step.• Model of intermediate
complexity.John Fielder
History of DayCent, cont’d
2001
CENTURYversion 5
monthly, C++
DayCentversion 5
daily, C++
DayCentversion 4
daily FORTRAN/C
DayCentversion 4.5
dailyFORTRAN/C
DayCent-Chem
daily, C++
PHREEQCversion 2.7, C
KeoughDel Grosso
Parton2001-present
Hillinski1998
CENTURYversion 4monthly
FORTRAN
http://www.nrel.colostate.edu/projects/century5/
Parton, Ojima,
Hartman 1994
Hartman, Baron,
2003-present
Parton, Ojima,
Schimel 1980s
PHREEQC soil reactions
Cation ExchangeAqueous reactionsMineral denudation
CO2 dissolution
DayCent-Chem Model Processes
Stream Flow
PHREEQC stream reactions
Aqueous reactionsMineral denudation
CO2 degassing
LEACHING
Atmospheric DepositionCations and Anions
UPTAKE SOM DECOMP.MINERALIZATIONNITRIF./DENITRIF.
LITTERFALL
TRANSLOCATION Snowpack
CO2
N2ONOx
CO2
CO2
Atmospheric CO2
Soil Organic C,N,P,S
INFILTRATION
DOC, Cations, Anions, CEC
Aquifer
BASEFLOW
RUNOFF
SUBLIMATION
ET
ANC, pH, BC, Cl, Al, SO42-
NO3-
NH4+
streamflow
DayCent-Chem Data Flow
KEYH2O + species
H2O only
aquifer
solution 1
solution 2
solution n
solution n+1
solution n+2
soln.pqi
soln.selPHREEQC
phreeqc.dat
soil layer 0
soil layer 1
soil layer n-1
snowpack
yes melt sublimation
ETwater vapor loss
norain?
atmospheric deposition
aqueous species + exchanger
aqueous species only
runoff
solution 1
solution 2
solution n
solution n+1
solution n+2
dry
Labile C in surface litter
Labile C in Organic Soil Layer
Mineral Soil
Stream DOC
DayCent-Chem organic C leaching
Soil DOC
l = leaching intensity:f(soil water flow)* f(soil texture)
r = release intensity:DOCReleaseFraction * total Q / baseflow
r
l
PHREEQC(pH/Redox/Equilibrium/Carbon)
• Speciation program to calculate saturation indices and distribution of aqueous species
• Multi-phase system equilibrium with gas phases (i.e. CO2, O2), minerals, aqueous species, exchange sites.
• Ion exchange (Gaines-Thomas convention)• Surface complexation (generalized two-layer, explicit
diffuse layer, or non-electrostatic model)• Distributed with several data bases of reactions and
equilibrium coefficients, enthalpy of reaction (∆H)*.
* “careful selection of aqueous species and thermodynamic data is left to the user”
Century C-cycle
Century N-cycle
DayCent-Chem Inputs/Outputs
Inputs:• daily precipitation &
min./max. air temperatures
• precipitation concentrations (NADP)
• dry:wet ratio or dry dep amounts
• soil properties: texture, Ksat, CEC
Outputs:• daily stream outflow
and chemistry• daily soil chemistry by
soil layer• SOM composition• NPP/Biomass• ET/Sublimation• NOx, N2O emissions
DayCent-Chem Processes
Does:• speciation • mineral weathering• CO2, O2 dissolution• cation exchange
(permanent charge)• plant/microbial uptake
of NH4+, NO3
-, P, S• pH computed as
charge balance• elution
Model development:• sulfate adsorption /
pH dependent charge• plant/microbial uptake
of base cations• organic acids• O3 effects on
production (?)
John Fielder
DayCent Publications• Del Grosso, S.J., W.J. Parton, A.R. Mosier, D.S. Ojima, and M.D. Hartman. 2000. Interaction
of Soil Carbon Sequestration and N2O Flux with Different Land Use Practices. Pp. 303-311 in: J.van Ham et al. eds. Non-CO2 Greenhouse Gasses: Scientific Understanding, Control, and Implementation. Kluwer Academic Publishers. Netherlands.
• Del Grosso, S.J., W.J. Parton, A.R. Mosier, M.D. Hartman, J. Brenner, D.S. Ojima, and D.S. Schimel. 2001. Simulated interaction of carbon dynamics and nitrogen trace gas fluxes using the DAYCENT model. Pages 303-332 In: M.J. Shaffer, L. Ma and S. Hansen (eds.) Modeling Carbon and Nitrogen Dynamics for Soil Management. Lewis Publishers. Boca Raton, Florida.
• Del Grosso, S.J., W.J. Parton, A.R. Mosier, M.D. Hartman, C.A. Keough, G.A. Peterson, D.S. Ojima, D.S. Schimel. 2001. Simulated effects of land use, soil texture, and precipitation on N gas emissions using DAYCENT. Pages 413-431 In: Follett, R.F., Hatfield, J.L. (eds.), Nitrogen in the Environment: Sources, Problems, and Management, Elsevier Science Publishers, The Netherlands.
• Eitzinger, J., W.J. Parton, and M. Hartman. 2000. Improvement and validation of a daily soil temperature submodel for freezing/thawing periods. Soil Science 165:525-534.
• Kelly, R.H., W.J. Parton, M.D. Hartman, L.K. Stretch, D.S. Ojima, and D.S. Schimel. 2000. Intra-annual and interannual variability of ecosystem processes in shortgrass steppe. Journal of Geophysical Research. 105:D15:20093-20100.
• Parton, W.J., A. Haxeltine, P. Thornton, R. Anne, and M. Hartman. 1996. Ecosystem sensitivity to land-surface models and leaf area index. Global and Planetary Change. 13:89-98.
• Parton, W.J., Hartman, M., Ojima, D., and David Schimel. 1998. DAYCENT and its land surface submodel: description and testing. Global and Planetary Change. 19:35-48.
• Parton, W.J., E.A. Holland, S.J. Del Grosso, M.D. Hartman, R.E. Martin, A.R. Mosier,D.S. Ojima and D.S. Schimel. 2001. Generalized model for NOx and N2O emissions from soils. Journal of Geophysical Research 106:17403-17419.
Niwot Ridge Daily Discharge
0.0
0.5
1.0
1.5
2.0
2.5
3.0
1989 1990 1991 1992 1993 1994 1995 1996 1997
cm/day
discharge simulated discharge measured
1/31/2006
R2 = 0.49
Annual VWM stream nitrate concentrationssimulated vs. Niwot Ridge observed
0
5
10
15
20
25
30
35
1989 1990 1991 1992 1993 1994 1995 1996
ueq/L
NO3-(ueq/L)
NO3(obs, ueq/L)
Niwot Daily Stream [NO3-]
0
10
20
30
40
1990 1991 1992 1993 1994 1995 1996 1997
ueq/L
NO3- NO3- (ueq/L) obs.
Annual VWM stream base cation concentrationssimulated vs. Niwot Ridge observed
0
25
50
75
100
125
1989 1990 1991 1992 1993 1994 1995 1996
ueq/L
BC (ueq/L)
BC(obs, ueq/L)
Niwot Daily Stream [Base Cations]
0
50
100
150
200
250
1990 1991 1992 1993 1994 1995 1996 1997
ueq/L
BC (ueq/L) BC (ueq/L) obs.
Niwot Daily Stream [ANC]
0
20
40
60
80
100
1990 1991 1992 1993 1994 1995 1996 1997
ueq/L
ANC(ueq/L) ANC (ueq/L) obs.
snowmelt winter
Snowmelt: ANC modelled too high
Winter: ANC modeled too low