Development of an atmospheric chemistry model coupled to the PALM model system 6.0: Implementation and first applications

Medientyp: Sonstige Veröffentlichung; E-Artikel

Titel: Development of an atmospheric chemistry model coupled to the PALM model system 6.0: Implementation and first applications

Beteiligte: Khan, Basit [VerfasserIn]; Banzhaf, Sabine [VerfasserIn]; Chan, Edward C. [VerfasserIn]; Forkel, Renate [VerfasserIn]; Kanani-Sühring, Farah [VerfasserIn]; Ketelsen, Klaus [VerfasserIn]; Kurppa, Mona [VerfasserIn]; Maronga, Björn [VerfasserIn]; Mauder, Matthias [VerfasserIn]; Raasch, Siegfried [VerfasserIn]; Russo, Emmanuele [VerfasserIn]; Schaap, Martijn [VerfasserIn]; Sühring, Matthias [VerfasserIn]

Erschienen: Katlenburg-Lindau : Copernicus, 2021

Ausgabe: published Version

Sprache: Englisch

DOI: https://doi.org/10.15488/12292; https://doi.org/10.5194/gmd-14-1171-2021

ISSN: 1991-959X

Schlagwörter: aerosol ; suburban area ; volatile organic compound ; gas phase reaction ; concentration (composition) ; pollutant source ; urban area ; Germany ; Berlin ; atmospheric modeling ; air quality ; atmospheric chemistry ; atmospheric pollution

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Beschreibung: In this article we describe the implementation of an online-coupled gas-phase chemistry model in the turbulence-resolving PALM model system 6.0 (formerly an abbreviation for Parallelized Large-eddy Simulation Model and now an independent name). The new chemistry model is implemented in the PALM model as part of the PALM-4U (PALM for urban applications) components, which are designed for application of the PALM model in the urban environment (Maronga et al., 2020). The latest version of the Kinetic PreProcessor (KPP, 2.2.3) has been utilized for the numerical integration of gas-phase chemical reactions. A number of tropospheric gas-phase chemistry mechanisms of different complexity have been implemented ranging from the photostationary state (PHSTAT) to mechanisms with a strongly simplified volatile organic compound (VOC) chemistry (e.g. the SMOG mechanism from KPP) and the Carbon Bond Mechanism 4 (CBM4; Gery et al., 1989), which includes a more comprehensive, but still simplified VOC chemistry. Further mechanisms can also be easily added by the user. In this work, we provide a detailed description of the chemistry model, its structure and input requirements along with its various features and limitations. A case study is presented to demonstrate the application of the new chemistry model in the urban environment. The computation domain of the case study comprises part of Berlin, Germany. Emissions are considered using street-type-dependent emission factors from traffic sources. Three chemical mechanisms of varying complexity and one no-reaction (passive) case have been applied, and results are compared with observations from two permanent air quality stations in Berlin that fall within the computation domain. Even though the feedback of the model's aerosol concentrations on meteorology is not yet considered in the current version of the model, the results show the importance of online photochemistry and dispersion of air pollutants in the urban boundary layer for high spatial and temporal resolutions. The ...

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Development of an atmospheric chemistry model coupled to the PALM model system 6.0: Implementation and first applications - [published Version]

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