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Models-3 Users’ Workshop 2003 Research Triangle Park, NC Computational Chemodynamics Laboratory EOHSI - Exposure Measurement & Assessment Division Evaluating Ozone Predictions from Photochemical Models Using NE-OPS 1999 Observations Qing Sun, Anatharaman Chandrasekar, Panos G. Georgopoulos Environmental and Occupational Health Sciences Institute, a joint project of UMDNJ — R. W. Johnson Medical School and Rutgers University 170 Frelinghuysen Road, Piscataway, New Jersey 08854 C. Russell Philbrick Penn State University, Department of Electrical Engineering and Applied Research Laboratory, University Park, Pennsylvania Bruce Doddridge University of Maryland, Department of Meteorology, College Park, Maryland One Atmosphere, One Community, One Modeling System: Models-3 Users’ Workshop October 27-29, 2003 Research Triangle Park, North Carolina

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Page 1: Models-3 Users’ Workshop 2003 Research Triangle Park, NC Computational Chemodynamics Laboratory EOHSI - Exposure Measurement & Assessment Division Evaluating

Models-3 Users’ Workshop 2003Research Triangle Park, NC

Computational Chemodynamics LaboratoryEOHSI - Exposure Measurement & Assessment Division

Evaluating Ozone Predictions from Photochemical Models Using NE-OPS 1999

ObservationsQing Sun, Anatharaman Chandrasekar, Panos G.

GeorgopoulosEnvironmental and Occupational Health Sciences Institute, a joint

project of UMDNJ — R. W. Johnson Medical School and Rutgers University

170 Frelinghuysen Road, Piscataway, New Jersey 08854

C. Russell PhilbrickPenn State University, Department of Electrical Engineering and

Applied Research Laboratory, University Park, Pennsylvania

Bruce DoddridgeUniversity of Maryland, Department of Meteorology, College Park,

Maryland

One Atmosphere, One Community, One Modeling System: Models-3 Users’ Workshop

October 27-29, 2003Research Triangle Park, North Carolina

Page 2: Models-3 Users’ Workshop 2003 Research Triangle Park, NC Computational Chemodynamics Laboratory EOHSI - Exposure Measurement & Assessment Division Evaluating

Computational Chemodynamics LaboratoryEOHSI - Exposure Measurement & Assessment Division

Models-3 Users’ Workshop 2003Research Triangle Park, NC

Outline

• Summary of the NE-OPS 1999 study

• Applications of and evaluation of CMAQ and CAMx

• Discussions and future work

Page 3: Models-3 Users’ Workshop 2003 Research Triangle Park, NC Computational Chemodynamics Laboratory EOHSI - Exposure Measurement & Assessment Division Evaluating

Computational Chemodynamics LaboratoryEOHSI - Exposure Measurement & Assessment Division

Models-3 Users’ Workshop 2003Research Triangle Park, NC

Summary of the NE-OPS Study

• North East - Oxidant and Particle Study (NE-OPS), sponsored by EPA

• Objectives:– Determine conditions leading to high O3 and PM– Local vs distant sources– Roles of meteorological properties

• Participants: Penn State, Millersville, Harvard SPH, Univ Maryland, SUNY at Albany, Rutgers, Brookhaven Nat Lab, PNNL, etc

• Location: centered at the Baxter water treatment plant in north Philadelphia

• Time span: 1999 – 2001 (this study uses data from July 11-25, 1999)

• Included both meteorological and air quality measurements• Measurements approaches: instrumented airplanes; Radar wind

profiler/RASS sounder; Lidar atmospheric profile sensor; tethered balloons; ozonesondes, rawinsondes, and ground based measurements of PM compositions.

Page 4: Models-3 Users’ Workshop 2003 Research Triangle Park, NC Computational Chemodynamics Laboratory EOHSI - Exposure Measurement & Assessment Division Evaluating

Computational Chemodynamics LaboratoryEOHSI - Exposure Measurement & Assessment Division

Models-3 Users’ Workshop 2003Research Triangle Park, NC

Nested Modeling Domain

Page 5: Models-3 Users’ Workshop 2003 Research Triangle Park, NC Computational Chemodynamics Laboratory EOHSI - Exposure Measurement & Assessment Division Evaluating

Computational Chemodynamics LaboratoryEOHSI - Exposure Measurement & Assessment Division

Models-3 Users’ Workshop 2003Research Triangle Park, NC

Monitor Stations and NE-OPS Flight Tracks

Page 6: Models-3 Users’ Workshop 2003 Research Triangle Park, NC Computational Chemodynamics Laboratory EOHSI - Exposure Measurement & Assessment Division Evaluating

Computational Chemodynamics LaboratoryEOHSI - Exposure Measurement & Assessment Division

Models-3 Users’ Workshop 2003Research Triangle Park, NC

Problem specifications

• Modeling period: 7/11/1999 to 7/25/1999• Three levels of nested grids (36km, 12km and

4km)• Grid dimensions: 72×60, 69×54 and 63×72• 14 Layers for CMAQ, 8 for CAMx• Meteorology prepared with MM5• Emissions prepared from USEPA’s 1998 NET

inventory, using SMOKE

Page 7: Models-3 Users’ Workshop 2003 Research Triangle Park, NC Computational Chemodynamics Laboratory EOHSI - Exposure Measurement & Assessment Division Evaluating

Computational Chemodynamics LaboratoryEOHSI - Exposure Measurement & Assessment Division

Models-3 Users’ Workshop 2003Research Triangle Park, NC

NOx and VOC Emissions

Page 8: Models-3 Users’ Workshop 2003 Research Triangle Park, NC Computational Chemodynamics Laboratory EOHSI - Exposure Measurement & Assessment Division Evaluating

Computational Chemodynamics LaboratoryEOHSI - Exposure Measurement & Assessment Division

Models-3 Users’ Workshop 2003Research Triangle Park, NC

Model Configuration

CMAQ CAMx

Advection Bott scheme Smolarkiewicz scheme

Turbulence K-theory based eddy formulation

K-theory based eddy formulation

Chemistry RADM2 or CB4 CB4 mechanism with updated isoprene chemistry

Number of gas-phase chemical species

59 (RADM2); 36 (CB4)

25

Number of chemical reactions

157 (RADM2); 93 (CB4)

96

Page 9: Models-3 Users’ Workshop 2003 Research Triangle Park, NC Computational Chemodynamics Laboratory EOHSI - Exposure Measurement & Assessment Division Evaluating

Computational Chemodynamics LaboratoryEOHSI - Exposure Measurement & Assessment Division

Models-3 Users’ Workshop 2003Research Triangle Park, NC

Run Time Comparison

CMAQ CAMx

Nesting 1-way nesting 2-way nesting

Type of machine used

Sun Fire 280R with dual 750 Hz UltraSPARC-III CPU and 4GB memory

Linux PC with single AMD Athlon XP 1800 and 1GB memory

Run Time 3-4 hours per model day for each grid

About 0.5 hour per model day for the 3-level nested grid

Page 10: Models-3 Users’ Workshop 2003 Research Triangle Park, NC Computational Chemodynamics Laboratory EOHSI - Exposure Measurement & Assessment Division Evaluating

Computational Chemodynamics LaboratoryEOHSI - Exposure Measurement & Assessment Division

Models-3 Users’ Workshop 2003Research Triangle Park, NC

Daily maxima of ground level ozone for 7/18/1999

CMAQ

CAMx

AirNow

Page 11: Models-3 Users’ Workshop 2003 Research Triangle Park, NC Computational Chemodynamics Laboratory EOHSI - Exposure Measurement & Assessment Division Evaluating

Computational Chemodynamics LaboratoryEOHSI - Exposure Measurement & Assessment Division

Models-3 Users’ Workshop 2003Research Triangle Park, NC

Daily maxima of ground level ozone for 7/19/1999

CMAQ

CAMx

AirNow

Page 12: Models-3 Users’ Workshop 2003 Research Triangle Park, NC Computational Chemodynamics Laboratory EOHSI - Exposure Measurement & Assessment Division Evaluating

Computational Chemodynamics LaboratoryEOHSI - Exposure Measurement & Assessment Division

Models-3 Users’ Workshop 2003Research Triangle Park, NC

Daily maxima of ground level ozone for 7/20/1999

CMAQ

CAMx

AirNow

Page 13: Models-3 Users’ Workshop 2003 Research Triangle Park, NC Computational Chemodynamics Laboratory EOHSI - Exposure Measurement & Assessment Division Evaluating

Computational Chemodynamics LaboratoryEOHSI - Exposure Measurement & Assessment Division

Models-3 Users’ Workshop 2003Research Triangle Park, NC

Space-time paired comparisons of ground level ozone with observation

CMAQ CAMx

Page 14: Models-3 Users’ Workshop 2003 Research Triangle Park, NC Computational Chemodynamics Laboratory EOHSI - Exposure Measurement & Assessment Division Evaluating

Computational Chemodynamics LaboratoryEOHSI - Exposure Measurement & Assessment Division

Models-3 Users’ Workshop 2003Research Triangle Park, NC

Quantile-quantile comparisons of ground level ozone with observation

CMAQ CAMx

Page 15: Models-3 Users’ Workshop 2003 Research Triangle Park, NC Computational Chemodynamics Laboratory EOHSI - Exposure Measurement & Assessment Division Evaluating

Computational Chemodynamics LaboratoryEOHSI - Exposure Measurement & Assessment Division

Models-3 Users’ Workshop 2003Research Triangle Park, NC

Model-to-model comparison

Page 16: Models-3 Users’ Workshop 2003 Research Triangle Park, NC Computational Chemodynamics Laboratory EOHSI - Exposure Measurement & Assessment Division Evaluating

Computational Chemodynamics LaboratoryEOHSI - Exposure Measurement & Assessment Division

Models-3 Users’ Workshop 2003Research Triangle Park, NC

Ozone Time Series Comparison between Model Predictions and Observations at Middlesex, NJ

Page 17: Models-3 Users’ Workshop 2003 Research Triangle Park, NC Computational Chemodynamics Laboratory EOHSI - Exposure Measurement & Assessment Division Evaluating

Computational Chemodynamics LaboratoryEOHSI - Exposure Measurement & Assessment Division

Models-3 Users’ Workshop 2003Research Triangle Park, NC

Ozone Time Series Comparison between Model Predictions and Observations at Philadelphia

Page 18: Models-3 Users’ Workshop 2003 Research Triangle Park, NC Computational Chemodynamics Laboratory EOHSI - Exposure Measurement & Assessment Division Evaluating

Computational Chemodynamics LaboratoryEOHSI - Exposure Measurement & Assessment Division

Models-3 Users’ Workshop 2003Research Triangle Park, NC

Selected NEOPS Flights

Page 19: Models-3 Users’ Workshop 2003 Research Triangle Park, NC Computational Chemodynamics Laboratory EOHSI - Exposure Measurement & Assessment Division Evaluating

Computational Chemodynamics LaboratoryEOHSI - Exposure Measurement & Assessment Division

Models-3 Users’ Workshop 2003Research Triangle Park, NC

Comparison with flight measurements (I)

Page 20: Models-3 Users’ Workshop 2003 Research Triangle Park, NC Computational Chemodynamics Laboratory EOHSI - Exposure Measurement & Assessment Division Evaluating

Computational Chemodynamics LaboratoryEOHSI - Exposure Measurement & Assessment Division

Models-3 Users’ Workshop 2003Research Triangle Park, NC

Comparison with flight measurements (II)

Page 21: Models-3 Users’ Workshop 2003 Research Triangle Park, NC Computational Chemodynamics Laboratory EOHSI - Exposure Measurement & Assessment Division Evaluating

Computational Chemodynamics LaboratoryEOHSI - Exposure Measurement & Assessment Division

Models-3 Users’ Workshop 2003Research Triangle Park, NC

Conclusions

• The two models, CMAQ and CAMx, predicted similar general patterns of pollutant spatial and temporal distributions

• There is considerable discrepancy of predictions by the two models for surface ozone:– CAMx significantly over-predicting ozone peaks

for certain days during the high ozone hours– CAMx predicts close-to-zero ozone during the

nights, probably reflecting the failure of the model to sufficiently account for the effects of an upper layer ozone reservoir accumulated during the daytime hours for the high ozone days

Page 22: Models-3 Users’ Workshop 2003 Research Triangle Park, NC Computational Chemodynamics Laboratory EOHSI - Exposure Measurement & Assessment Division Evaluating

Computational Chemodynamics LaboratoryEOHSI - Exposure Measurement & Assessment Division

Models-3 Users’ Workshop 2003Research Triangle Park, NC

On-going and future work

• Parallel processing on Linux cluster• Emissions from 1999 and projected 2001(?)

NEI• Seasonal or annual runs of CMAQ and CAMx • Linking the annual air quality applications with

MENTOR/SHEDS for exposure/dose analyses

MENTOR – Modeling Environment for Total Risk

SHEDS – Stochastic Human Exposure and Dose Simulation

Page 23: Models-3 Users’ Workshop 2003 Research Triangle Park, NC Computational Chemodynamics Laboratory EOHSI - Exposure Measurement & Assessment Division Evaluating

Computational Chemodynamics LaboratoryEOHSI - Exposure Measurement & Assessment Division

Models-3 Users’ Workshop 2003Research Triangle Park, NC

Acknowledgements

• State of New Jersey Department of Environmental Protection (NJDEP) funded Ozone Research Center (ORC)

• U.S. EPA Center for Exposure and Risk Modeling (CERM) (EPAR-827033)

• U.S. EPA funded NorthEast Oxidant and Particle Study (NE-OPS) (EPA-TPSU-UMDNJ-826373-14)