DOI QR코드

DOI QR Code

Ozone Simulations over the Seoul Metropolitan Area for a 2007 June Episode, Part I: Evaluating Volatile Organic Compounds Emissions Speciated for the SAPRC99 Chemical Mechanism

2007년 6월 수도권 오존모사 I - 광화학측정자료를 이용한 SAPRC99 화학종별 휘발성유기물질 배출량 입력자료 평가

  • Kim, Soon-Tae (Division of Environmental, Civil & Transportation Engineering, Ajou University)
  • 김순태 (아주대학교 환경건설교통공학부)
  • Received : 2011.07.06
  • Accepted : 2011.09.09
  • Published : 2011.10.31

Abstract

Volatile organic compound (VOC) emissions in the 2007 CAPSS (Clean Air Protection Supporting System) emissions inventory are chemically speciated for the SAPRC99 (Statewide Air Pollution Research Center 99) mechanism, following the Source Classification Code (SCC) matching method to borrow the U.S.EPA's chemical speciation profiles. CMAQ simulations with High-order Direct Decoupled Method (HDDM) are in turn applied to evaluate uncertainty in the method by comparing the simulated model VOC species to the observations in the Seoul Metropolitan Area (SMA) for a 2007 June episode. Simulations under-predicted ALK1 to ALK4 in SAPRC99 by a factor of 2 to 5 and over-predicted ALK5 by a factor of 7.5 while ARO1, ARO2, OLE1, and ethylene (ETH) are comparable to the observations, showing relative difference by 10 to 30%. OLE2 emissions are roughly 4 times overestimated. Emission rates for individual VOC model species are revised referring to the ratio of simulated to observed concentrations. Impact of the VOC emission changes on the overall ozone prediction was insignificant for the days of which 1-hr maximum ozone are lower than 100 ppb. However, simulations showed ozone difference by 5 to 10 ppb when high ozone above 120 ppb was observed in the vicinity of Seoul. This result suggests that evaluations on individual model VOC emissions be necessary to lead ozone control plans to the right direction. Moreover, the simulated ratios of ARO1 and ARO2 to $NO_x$ are roughly 50% lower than the observed ones, which imply that adjustment in $NO_x$ and VOC emission rates may be required to mimic the real VOC/$NO_x$ condition over the area.

Keywords

References

  1. 국립환경과학원(2010) 대기질 모델링 가이드 라인(안) 마련 연구, 최종보고서.
  2. 환경부(2010) 대기환경규제지역 지정기준 개선 및 관리 방안, 최종보고서.
  3. Byun, D.W. and J.K.S. Ching (1999) Science Algorithms of the EPA Models-3 Community Multi-scale Air Quality (CMAQ) Modeling System, EPA Report, EPA/600/R-99/030, NERL, Research Triangle Park, NC.
  4. Byun, D.W., S. Kim, B. Carder, I.B. OH, F.Y. Cheng, M. Jang, C.K. Song, and F. Ngan (2006) Modeling Strategy in Support of TexAQS-II and 8-Hour Ozone Assessment: Task D, Evaluation of Baseline CAMx and CMAQ Simulations for the East Texas Source Apportionment Study, Institute for Multi-dimensional Air Quality Studies, University of Houston.
  5. Byun, D.W., S. Kim, and S.B. Kim (2007) Evaluation of air quality models for the simulation of a high ozone episode in the Houston metropolitan area, Atmospheric Environment, 41, 837-853. https://doi.org/10.1016/j.atmosenv.2006.08.038
  6. Carter, W.P.L. (1990) A detailed mechanism for the gas-phase atmospheric reactions of organic compounds, Atmospheric Environment, 24A, 481-515. https://doi.org/10.1016/0960-1686(90)90005-8
  7. Carter, W.P.L. (1999) Documentation of the SAPRC-99 Chemical Mechanism for VOC Reactivity Assessment, Report to California Air Resources Board, Contracts 92-329 and 95-308.
  8. Carter, W.P.L., L. Wang, and J.B. Milford (2000) Reactivity estimates for aromatic compounds, Part 2: Uncertainty in incremental reactivities, Atmospheric Environment, 34(25), 4349-4360. https://doi.org/10.1016/S1352-2310(00)00206-5
  9. Cohan, D.S., A. Hakami, Y. Hu, and A.G. Russell (2005) Nonlinear response of ozone to emissions: Source apportionment and sensitivity analysis, Environ. Sci. Technol., 39, 6739-6748. https://doi.org/10.1021/es048664m
  10. Czader, B., D.W. Byun, S. Kim, and W.P.L. Carter (2008) A study of VOC reactivity in the Houston-Galveston air mixture utilizing an extended version of SAPRC-99 chemical mechanism, Atmospheric Environment, 42, 5733-5742. https://doi.org/10.1016/j.atmosenv.2008.01.039
  11. Derwent, R.G., M.E. Jenkin, and S.M. Saunders (1996) Photochemical ozone creation potentials for a large number of reactive hydrocarbons under European conditions, Atmospheric Environment, 30, 181-199. https://doi.org/10.1016/1352-2310(95)00303-G
  12. Duncan, B.N., Y. Yoshida, J.R. Olson, S. Sillman, R.V. Martin, L. Lamsal, Y. Hu, K.E. Pickering, C. Retscher, D.J. Allen, and J.H. Crawford (2010) Application of OMI observations to a space-based indicator of $NO_x$ and VOC controls on surface ozone formation, Atmospheric Environment, 44, 2213-2223. https://doi.org/10.1016/j.atmosenv.2010.03.010
  13. ENVIRON (2008) Higher-Order Decoupled Direct Method (HDDM) for Ozone Modeling Sensitivity Analyses and Code Refinements, Final report to Texas Commission on Environmental Quality.
  14. ENVIRON (2010) User's guide to the Comprehensive Air Quality Model with Extension (CAMx) version 5.30. http://www.camx.com.
  15. Guenther, A., T. Karl, P. Harley, C. Wiedinmyer, P.I. Palmer, and C. Geron (2006) Estimates of global terrestrial isoprene emissions using MEGAN (Model of Emissions of Gases and Aerosols from Nature), Atmospheric Chemistry and Physics, 6, 3181-3210. https://doi.org/10.5194/acp-6-3181-2006
  16. Han, J.S., K.J. Moon, R.H. Kim, S.A. Sin, Y.D. Hong, and I.R. Jong (2006) Preliminary source apportionment of ambient VOCs measured in Seoul metropolitan area by positive matrix factorization, Journal of Korean Society for Atmospheric Environment, 22(1), 85-97. (in Korean with English abstract)
  17. Hogrefe, C., G. Sistla, E. Zalewsky, W. Hao, and J.Y. Ku (2003) An assessment of the emissions inventory processing systems EMS-2001 and SMOKE in grid-based air quality models, J. Air Waste Manage. Assoc., 53(9), 1121-1129. https://doi.org/10.1080/10473289.2003.10466261
  18. Hwang, J.H., H.M. Lee, and G.W. Lee (2005) Study on the Photochemical Ozone in the Atmosphere of Seoul by Measuring the Ambient Formaldehyde, Proceeding of the 49th Meeting of KOSAE, 280-282.
  19. Hwang, J.H., H.M. Lee, G.W. Lee, and J.S. Han (2006) Distributions of formaldehyde in Seoul in June, 2005, Journal of Korean Society for Atmospheric Environment, 22(1), 63-71. (in Korean with English abstract)
  20. KEI (2006) Air Quality Modeling System-Development of Emissions Preparation System with the CAPSS, Final report, Seoul, Korea.
  21. Kim, J.Y., J.S. Kim, J.Y. Hong, D.I. Jung, S.J. Ban, and Y.M. Lee (2008a) Assessment of changed input modules with SMOKE model, Journal of Korean Society for Atmospheric Environment, 24(3), 284-299. (in Korean with English abstract) https://doi.org/10.5572/KOSAE.2008.24.3.284
  22. Kim, S. (2011) Estimating influence of biogenic volatile organic compounds on high ozone concentrations over the Seoul metropolitan area during two episodes in 2004 and 2007 June, Journal of Korean Society for Atmospheric Environment, submitted for publication. (in Korean with English abstract)
  23. Kim, S., N.K. Moon, and D.W. Byun (2008b) Korean emissions inventory processing using the US EPA's SMOKE system, Asian Journal of Atmospheric Environment, 2(1), 34-46. https://doi.org/10.5572/ajae.2008.2.1.034
  24. Kim, S., N.K. Moon, J.Y. Hong, and J.Y. Kim (2009) Source Apportionment Simulations of NO_2$ and Ozone Concentrations over Seoul Metropolitan Area based on the CAPSS emissions inventory, Proceeding of the 49th Meeting of KOSAE, 280-282.
  25. Kleinman, L.I. (2005) The dependence of tropospheric ozone production rate on ozone precursors, Atmospheric Environment, 39, 575-586. https://doi.org/10.1016/j.atmosenv.2004.08.047
  26. Lee, J.B. and K.J. Hwang (2005) Evaluation of VOCs Emissions Using PAMS Data and MODEL-3/CMAQ, Proceeding of the 39th Meeting of KOSAE, 194-195.
  27. Lee, J.B. and S.G. Park (2006) Evaluation of VOC Concentration Simulated by Photochemical Model Using PAMS Data, Proceeding of the 43rd Meeting of KOSAE, 448-449.
  28. Lee, J.H., J.S. Han, H.K. Yun, and S.Y. Cho (2007) Evaluation of incremental reactivity and ozone production contribution of VOCs using the PAMS data in Seoul metropolitan area, Journal of Korean Society for Atmospheric Environment, 23(3), 286-296. (in Korean with English abstract) https://doi.org/10.5572/KOSAE.2007.23.3.286
  29. Lee, Y.M., H.J. Lee, C. Yu, J.H. Song, J.Y. Kim, and J.H. Hong (2009) Verification of mobile emission for CMAQ using an observation-based approach in Seoul metropolitan area, Journal of Korean Society for Atmospheric Environment, 25(5), 369-381. https://doi.org/10.5572/KOSAE.2009.25.5.369
  30. NIER (2008) Air Quality Modeling System (II), Final report.
  31. Ryerson, T.B., M. Trainer, W.M. Angevine, C.A. Brock, R.W. Dissly, F.C. Fe hsenfeld, G.J. Frost, P.D. Goldan, J.S. Holloway, G. Hubler, R.O. Jakoubek, W.C. Kuster, J.A. Neuman, D.K. Jr Nicks, D.D. Parrish, J.M. Roberts, and D.T. Sueper (2003) Effect of petrochemical industrial emissions of reactive alkenes and $NO_x$ on Tropospheric ozone formation in Houston, Texas, Journal of Geophysical Research, 108, (D8), 4249. https://doi.org/10.1029/2002JD003070
  32. U.S. Environmental Protection Agency (2007) Guidance for Setting Reasonable Progress Goals under the Regional Haze Program, Research Triangle Park, NC.
  33. Wert, B.P., M. Trainer, A. Fried, T.B. Ryerson, B. Henry, W. Potter, W.M. Angevine, E. Atlas, S.G. Donnelly, F.C. Fehsenfeld, G.J. Frost, P.D. Goldan, A. Hansel, J.S. Holloway, G. Hubler, W.C. Kuster, D.K. Nicks Jr., J.A. Neuman, D.D. Parrish, S. Schauffle, J. Stutz, D.T. Sueper, C. Wiedinmyer, and A. Wisthaler (2003) Signatures of terminal alkene oxidation in airborne formaldehyde measurements during TexAQS 2000, Journal of Geophysical Research, 108, (D3), 4104 https://doi.org/10.1029/2002JD002502
  34. Whitten, G.Z., H. Hogo, and J.P. Killus (1980) The carbon bond mechanism: a condensed kinetic mechanism for photochemical smog, Envir. Sci. Technol., 14, 690-701. https://doi.org/10.1021/es60166a008

Cited by

  1. Estimating Influence of Biogenic Volatile Organic Compounds on High Ozone Concentrations over the Seoul Metropolitan Area during Two Episodes in 2004 and 2007 June vol.27, pp.6, 2011, https://doi.org/10.5572/KOSAE.2011.27.6.751
  2. Ozone Simulations over the Seoul Metropolitan Area for a 2007 June Episode, Part V: Application of CMAQ-HDDM to Predict Ozone Response to Emission Change vol.27, pp.6, 2011, https://doi.org/10.5572/KOSAE.2011.27.6.772
  3. Characteristics of Ozone Precursor Emissions and POCP in the Biggest Port City in Korea vol.9, pp.2, 2015, https://doi.org/10.5572/ajae.2015.9.2.146
  4. Domestic Ozone Sensitivity to Chinese Emissions Inventories: A Comparison between MICS-Asia 2010 and INTEX-B 2006 vol.33, pp.5, 2017, https://doi.org/10.5572/KOSAE.2017.33.5.480