Changes between Version 16 and Version 17 of doc/app/chemistry_parameters
- Timestamp:
- Oct 11, 2018 8:31:15 AM (6 years ago)
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doc/app/chemistry_parameters
v16 v17 8 8 The main routines and the driver of the chemistry module is included in chemistry_model_mod.f90. The main routines and the driver of the chemistry module is included in chemistry_model_mod.f90, subroutines are in chem_gasphase_mod.f90, chem_photolysis_mod.f90, and chem_emissions.f90. 9 9 10 The module chem_gasphase_mod.f90, where the gas phase chemistry rate equations are solved within PALM4U depends on the chosen chemical mechanism. chem_gasphase_mod.f90 is generated by a preprocessor that is based on the Kinetic Pre-Processor KPP (Damian et al., 2002, Sandu et al., 2006), Release 2.2.3 from November 2012 (http://people.cs.vt.edu/asandu/Software/Kpp/, kpp-2.2.3.tar.gz) and an adapted version of the KPP postprocessor KP4 (Jöckel et al, 2010, https://www.geosci-model-dev.net/3/717/2010/). This adapted Version of kp4 which converts the KPP-generated code to a PALM4U module is named kpp4palm. 10 The module chem_gasphase_mod.f90, where the gas phase chemistry rate equations are solved within PALM4U depends on the chosen chemical mechanism. chem_gasphase_mod.f90 is generated by a preprocessor that is based on the Kinetic Pre-Processor KPP (Damian et al., 2002, Sandu et al., 2006), Release 2.2.3 from November 2012 (http://people.cs.vt.edu/asandu/Software/Kpp/, kpp-2.2.3.tar.gz) and an adapted version of the KPP postprocessor KP4 (Jöckel et al, 2010, https://www.geosci-model-dev.net/3/717/2010/). This adapted Version of kp4 which converts the KPP-generated code to a PALM4U module is named kpp4palm. 11 11 12 12 The chemical preprocessor is located in the subdirectory `UTIL/chemistry/gasphase_preproc`. … … 15 15 * CBM4: Carbon Bond Mechanism (Gery et al. 1989, 32 compounds, 81 reactions)\\ 16 16 * SMOG: Photochemical smog mechanism (13 compounds, 12 reactions)\\ 17 * SIMPLE: Simplified versio of SMOG (9 compounds, 7 reactions)\\17 * SIMPLE: Simplified version of SMOG (9 compounds, 7 reactions)\\ 18 18 * SIMPLEP: SIMPLE plus one tracer named PM10 (10 compounds, 7 real reactions plus one dummy 'reaction')\\ 19 19 * PHSTAT: Photo-stationary state (3 compounds, 2 reactions)\\ … … 22 22 * PASSIVE1: Passive tracers (1 compound, 0 reactions)\\ 23 23 * PASSIVE: Passive tracers (2 compounds, 0 reactions)\\ 24 and the mechanisms mentioned above plus one passive Tracer (e.g SIMPLEP: SIMPLE .The list will be extended further.24 The list will be extended further. 25 25 26 For details about preparing a chem_gasphase_mod.f90 for different chemical mechanism than the one that comes with checkout of PALM4U (currently PASSIVE) see Readme_KPP4PALM.odt in the PALM4U subdirectory UTIL/chemistry/gasphase_preproc. 26 Ready-to-use chem_gasphase_mod.f90 files for each of the mechanisms are supplied in the subdirectories `Util/chemistry/gasphase_preproc/mechanisms/def_MECH`, where 'MECH' stands for any of the available mechanisms. 27 For using a different chemical mechanism than the one that comes with checkout of PALM4U (currently PASSIVE), copy your preferred mechanism into the `SOURCE`directory. 27 28 28 A main factor influencing atmospheric chemistry are the emissions of reactive compounds. In PALM4U emissions can be appliued in three different ways:\\ 29 For details about preparing a chem_gasphase_mod.f90 from scratch see `Readme_KPP4PALM.odt` in the PALM4U subdirectory `UTIL/chemistry/gasphase_preproc`. 30 31 A main factor influencing atmospheric chemistry are the emissions of reactive compounds. In PALM4U emissions can be applied in three different ways:\\ 29 32 * PARAMETERIZED: Traffic emissions are parameterized depending on the the values of street_type in the static file. Emission values for each street type and chemical compound must be supplied in the namelist as described beow. No other emissions are considered. street_type can be obtained from Openstreetmap.\\ 30 33 * DEFAULT: Gridded yearly emissions must be supplied by the user as specified in the PIDS document (see sample emissions file). Typical temporal variations are apllied by PALM4U.\\