Development of the high-order decoupled direct method in three dimensions for particulate matter: enabling advanced sensitivity analysis in air quality models
W. Zhang, S. L. Capps, Y. Hu, A. Nenes, S. L. Napelenok and A. G. Russell
Geoscientific model development, v 5(2), pp 355-368
The high-order decoupled direct method in three dimensions for particulate matter (HDDM-3D/PM) has been implemented in the Community Multiscale Air Quality (CMAQ) model to enable advanced sensitivity analysis. The major effort of this work is to develop high-order DDM sensitivity analysis of ISORROPIA, the inorganic aerosol module of CMAQ. A case-specific approach has been applied, and the sensitivities of activity coefficients and water content are explicitly computed. Stand-alone tests are performed for ISORROPIA by comparing the sensitivities (first- and second-order) computed by HDDM and the brute force (BF) approximations. Similar comparison has also been carried out for CMAQ sensitivities simulated using a week-long winter episode for a continental US domain. Second-order sensitivities of aerosol species (e.g., sulfate, nitrate, and ammonium) with respect to domain-wide SO2, NOx, and NH3 emissions show agreement with BF results, yet exhibit less noise in locations where BF results are demonstrably inaccurate. Second-order sensitivity analysis elucidates poorly understood nonlinear responses of secondary inorganic aerosols to their precursors and competing species. Adding second-order sensitivity terms to the Taylor series projection of the nitrate concentrations with a 50% reduction in domain-wide NOx or SO2 emissions rates improves the prediction with statistical significance.
Development of the high-order decoupled direct method in three dimensions for particulate matter: enabling advanced sensitivity analysis in air quality models
Creators
W. Zhang - Georgia Institute of Technology
S. L. Capps - Georgia Institute of Technology
Y. Hu - Georgia Institute of Technology
A. Nenes - Georgia Institute of Technology
S. L. Napelenok - US Environment Protection Agency, Research Triangle Park, North Carolina, USA
A. G. Russell - Georgia Institute of Technology
Publication Details
Geoscientific model development, v 5(2), pp 355-368
Publisher
Copernicus Gesellschaft Mbh
Number of pages
14
Grant note
Conoco-Phillips Inc.
RD83215910; RD83362601; RD83096001; RD82897602; RD83107601 / US EPA; United States Environmental Protection Agency
Resource Type
Journal article
Language
English
Academic Unit
Civil, Architectural, and Environmental Engineering
Web of Science ID
WOS:000304060600007
Scopus ID
2-s2.0-84869036028
Other Identifier
991019186627704721
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