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Aerosol Water Calculation #37
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Commits on Jun 24, 2024
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Add test yaml file for aerosol water calculation
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Add yaml files for initial gas and aerosol state
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Add shell script for executing ZSR test
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Add main wrapper script for testing aerosol water calculation. Curren…
…tly IonPair attributes are hard-coded, future updates will move IonPair attribute assignment to AerosolModelData parsing.
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Include example script for aerosol water calc.
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Add IonPair struct for ZSR calculations (either EQSAM or Jacobson bas…
…ed calculation)
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Add method for calculating aerosol water content. NOTE: molecular wei…
…ghts are assigned via hard-coded map in TChem_ZSR.cpp wrapper, future behavior will access molecular weights from AerosolModelData instance attributes
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Add parsing of aerosol water sub model attributes. NOTE: current impl…
…ementation does not allow accessing sub model attributes outside the scope of the initChem parser yet.
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Commits on Jun 25, 2024
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Add vector container for ion pairs, aerosol_water data structure for …
…encapsulating ion pair vector
Frederick committedJun 25, 2024 Configuration menu - View commit details
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Add AerosolWater data structure declaration
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Commits on Jul 2, 2024
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Remove hard-coded ionpair instances, use aerosol_sp_name_idx map to a…
…ssign state vector quantities to relevant indices, revise arguments to aerosol water team invoke method.
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Change ion_quantities to a map and add an additional map for holding …
…molecular weights. Revise the name of the aerosol water type and add a 1-d dual view (tentative).
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Add aerowater_model to public attributes and template some commented …
…out code for adding attributes to the aerosol model constant data subclass
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Change ion_quantities to maps and add map for ion molecular weights
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Revise team_invoke arguments (major change is passing the aerosol mod…
…el data instead of ion_pair objects), compute aerosol water for all ionpair objects that are attributes of the aerowater_model class, remove code using a lookup dictionary for computing molecular weights with values assigned in the parser module.
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Commits on Jul 16, 2024
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Add variables for index location of RH and aqueous phase water, updat…
…e arguments to aerosol_water_single_particle team invoke
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Update IonPair definition to use primitive types
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Remove references to aerowater_model data structure, restucture code …
…to assign various IonPair attributes with corresponding updated primitive types, add code for assigning a dual 1d view of the aerowater_params
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Add public vars to AMD: number of aerosol water ion pairs, 1d dual vi…
…ew of ionpair objects. Add corresponding attributes under aerosolmodel_constdata
Frederick committedJul 16, 2024 Configuration menu - View commit details
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Utilize aerosolmodel_constdata instead of aerosolmodel_data, update c…
…ode for acessing data with primitive type attributes, use a switch for calculation type (jacobson or eqsam)
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Commits on Jul 18, 2024
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Commits on Aug 19, 2024
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Remove deprecated use of std::string variables
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Use tines library instead of std library for various math functions
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Commits on Aug 20, 2024
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Fix compile error (reference to nonexistent function), replace with c…
…onditional statement to determine effective RH
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Commits on Aug 22, 2024
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Add basic schematic for aerosol water unit test based on the SIMPOL t…
…est case
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Commits on Aug 23, 2024
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Change references to state to utilize 1d view based on TChem conventi…
…on (gases + aerosol species per particle), set arguments to team_invoke() to type const beside the state view
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Swap out use of conventional state array with 1D view consistent with…
… other references to TChem's state variable.
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Clarify that the aerosol water model uses ZSR method
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Add constant definitions for water molality and water molecular weight
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Replace hard-coded value with values from TChem_Util.hpp
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Add loop over batch members and inner loop over RH for calculating wa…
…ter content [CURRENTLY FAILING]
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Change type of state variable to const
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Use 1d view value and real types via the aerosol_water_single_particl…
…e_type, change state variable to value type (real type was incorrect)
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Commits on Aug 26, 2024
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Removed unused ion index variable
Frederick committedAug 26, 2024 Configuration menu - View commit details
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Fix bug with state variable having wrong view type declaration
Frederick committedAug 26, 2024 Configuration menu - View commit details
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Fix bug with loop over RH (ensure it starts at zero), assign aerosol …
…water values for each RH to aerowater view, copy from device to host and write values to file for comparison against host output
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