CAMP 1.0.0
Chemistry Across Multiple Phases
Macros | Functions
rxn_wet_deposition.c File Reference

Wet deposition reaction solver functions. More...

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Macros

#define TEMPERATURE_K_   env_data[0]
 
#define PRESSURE_PA_   env_data[1]
 
#define RXN_ID_   (int_data[0])
 
#define NUM_SPEC_   (int_data[1])
 
#define SCALING_   float_data[0]
 
#define RATE_CONSTANT_   (rxn_env_data[0])
 
#define BASE_RATE_   (rxn_env_data[1])
 
#define NUM_INT_PROP_   2
 
#define NUM_FLOAT_PROP_   1
 
#define NUM_ENV_PARAM_   2
 
#define REACT_(s)   (int_data[NUM_INT_PROP_ + s] - 1)
 
#define DERIV_ID_(s)   int_data[NUM_INT_PROP_ + NUM_SPEC_ + s]
 
#define JAC_ID_(s)   int_data[NUM_INT_PROP_ + 2 * NUM_SPEC_ + s]
 

Functions

void rxn_wet_deposition_get_used_jac_elem (int *rxn_int_data, double *rxn_float_data, Jacobian *jac)
 Flag Jacobian elements used by this reaction.
 
void rxn_wet_deposition_update_ids (ModelData *model_data, int *deriv_ids, Jacobian jac, int *rxn_int_data, double *rxn_float_data)
 Update the time derivative and Jacbobian array indices.
 
bool rxn_wet_deposition_update_data (void *update_data, int *rxn_int_data, double *rxn_float_data, double *rxn_env_data)
 Update reaction data.
 
void rxn_wet_deposition_update_env_state (ModelData *model_data, int *rxn_int_data, double *rxn_float_data, double *rxn_env_data)
 Update reaction data for new environmental conditions.
 
void rxn_wet_deposition_calc_deriv_contrib (ModelData *model_data, TimeDerivative time_deriv, int *rxn_int_data, double *rxn_float_data, double *rxn_env_data, realtype time_step)
 Calculate contributions to the time derivative \(f(t,y)\) from this reaction.
 
void rxn_wet_deposition_calc_jac_contrib (ModelData *model_data, Jacobian jac, int *rxn_int_data, double *rxn_float_data, double *rxn_env_data, realtype time_step)
 Calculate contributions to the Jacobian from this reaction.
 
void rxn_wet_deposition_print (int *rxn_int_data, double *rxn_float_data)
 Print the reaction parameters.
 
void * rxn_wet_deposition_create_rate_update_data ()
 Create update data for new wet deposition rates.
 
void rxn_wet_deposition_set_rate_update_data (void *update_data, int rxn_id, double base_rate)
 Set rate update data.
 

Detailed Description

Wet deposition reaction solver functions.

Definition in file rxn_wet_deposition.c.

Macro Definition Documentation

◆ BASE_RATE_

#define BASE_RATE_   (rxn_env_data[1])

Definition at line 24 of file rxn_wet_deposition.c.

◆ DERIV_ID_

#define DERIV_ID_ (   s)    int_data[NUM_INT_PROP_ + NUM_SPEC_ + s]

Definition at line 29 of file rxn_wet_deposition.c.

◆ JAC_ID_

#define JAC_ID_ (   s)    int_data[NUM_INT_PROP_ + 2 * NUM_SPEC_ + s]

Definition at line 30 of file rxn_wet_deposition.c.

◆ NUM_ENV_PARAM_

#define NUM_ENV_PARAM_   2

Definition at line 27 of file rxn_wet_deposition.c.

◆ NUM_FLOAT_PROP_

#define NUM_FLOAT_PROP_   1

Definition at line 26 of file rxn_wet_deposition.c.

◆ NUM_INT_PROP_

#define NUM_INT_PROP_   2

Definition at line 25 of file rxn_wet_deposition.c.

◆ NUM_SPEC_

#define NUM_SPEC_   (int_data[1])

Definition at line 21 of file rxn_wet_deposition.c.

◆ PRESSURE_PA_

#define PRESSURE_PA_   env_data[1]

Definition at line 18 of file rxn_wet_deposition.c.

◆ RATE_CONSTANT_

#define RATE_CONSTANT_   (rxn_env_data[0])

Definition at line 23 of file rxn_wet_deposition.c.

◆ REACT_

#define REACT_ (   s)    (int_data[NUM_INT_PROP_ + s] - 1)

Definition at line 28 of file rxn_wet_deposition.c.

◆ RXN_ID_

#define RXN_ID_   (int_data[0])

Definition at line 20 of file rxn_wet_deposition.c.

◆ SCALING_

#define SCALING_   float_data[0]

Definition at line 22 of file rxn_wet_deposition.c.

◆ TEMPERATURE_K_

#define TEMPERATURE_K_   env_data[0]

Definition at line 17 of file rxn_wet_deposition.c.

Function Documentation

◆ rxn_wet_deposition_calc_deriv_contrib()

void rxn_wet_deposition_calc_deriv_contrib ( ModelData model_data,
TimeDerivative  time_deriv,
int *  rxn_int_data,
double *  rxn_float_data,
double *  rxn_env_data,
realtype  time_step 
)

Calculate contributions to the time derivative \(f(t,y)\) from this reaction.

Parameters
model_dataPointer to the model data, including the state array
time_derivTimeDerivative object
rxn_int_dataPointer to the reaction integer data
rxn_float_dataPointer to the reaction floating-point data
rxn_env_dataPointer to the environment-dependent parameters
time_stepCurrent time step being computed (s)

Definition at line 149 of file rxn_wet_deposition.c.

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◆ rxn_wet_deposition_calc_jac_contrib()

void rxn_wet_deposition_calc_jac_contrib ( ModelData model_data,
Jacobian  jac,
int *  rxn_int_data,
double *  rxn_float_data,
double *  rxn_env_data,
realtype  time_step 
)

Calculate contributions to the Jacobian from this reaction.

Parameters
model_dataPointer to the model data
jacReaction Jacobian
rxn_int_dataPointer to the reaction integer data
rxn_float_dataPointer to the reaction floating-point data
rxn_env_dataPointer to the environment-dependent parameters
time_stepCurrent time step being calculated (s)

Definition at line 179 of file rxn_wet_deposition.c.

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◆ rxn_wet_deposition_create_rate_update_data()

void * rxn_wet_deposition_create_rate_update_data ( )

Create update data for new wet deposition rates.

Returns
Pointer to a new rate update data object

Definition at line 218 of file rxn_wet_deposition.c.

◆ rxn_wet_deposition_get_used_jac_elem()

void rxn_wet_deposition_get_used_jac_elem ( int *  rxn_int_data,
double *  rxn_float_data,
Jacobian jac 
)

Flag Jacobian elements used by this reaction.

Parameters
rxn_int_dataPointer to the reaction integer data
rxn_float_dataPointer to the reaction floating-point data
jacJacobian

Definition at line 38 of file rxn_wet_deposition.c.

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◆ rxn_wet_deposition_print()

void rxn_wet_deposition_print ( int *  rxn_int_data,
double *  rxn_float_data 
)

Print the reaction parameters.

Parameters
rxn_int_dataPointer to the reaction integer data
rxn_float_dataPointer to the reaction floating-point data

Definition at line 205 of file rxn_wet_deposition.c.

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◆ rxn_wet_deposition_set_rate_update_data()

void rxn_wet_deposition_set_rate_update_data ( void *  update_data,
int  rxn_id,
double  base_rate 
)

Set rate update data.

Parameters
update_dataPointer to an allocated rate update data object
rxn_idId of wet deposition reactions to update
base_rateNew pre-scaling wet deposition rate

Definition at line 233 of file rxn_wet_deposition.c.

◆ rxn_wet_deposition_update_data()

bool rxn_wet_deposition_update_data ( void *  update_data,
int *  rxn_int_data,
double *  rxn_float_data,
double *  rxn_env_data 
)

Update reaction data.

Wet deposition reactions can have their base (pre-scaling) rate constants updated from the host model based on the calculations of an external module. The structure of the update data is:

  • int rxn_id (Id of one or more wet deposition reactions set by the host model using the camp_rxn_wet_deposition::rxn_wet_deposition_t::set_rxn_id function prior to initializing the solver.)
  • double rate_const (New pre-scaling rate constant.)
Parameters
update_dataPointer to the updated reaction data
rxn_int_dataPointer to the reaction integer data
rxn_float_dataPointer to the reaction floating-point data
rxn_env_dataPointer to the environment-dependent data
Returns
Flag indicating whether this is the reaction to update

Definition at line 95 of file rxn_wet_deposition.c.

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◆ rxn_wet_deposition_update_env_state()

void rxn_wet_deposition_update_env_state ( ModelData model_data,
int *  rxn_int_data,
double *  rxn_float_data,
double *  rxn_env_data 
)

Update reaction data for new environmental conditions.

For wet deposition reactions this only involves recalculating the rate constant.

Parameters
model_dataPointer to the model data
rxn_int_dataPointer to the reaction integer data
rxn_float_dataPointer to the reaction floating-point data
rxn_env_dataPointer to the environment-dependent parameters

Definition at line 124 of file rxn_wet_deposition.c.

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◆ rxn_wet_deposition_update_ids()

void rxn_wet_deposition_update_ids ( ModelData model_data,
int *  deriv_ids,
Jacobian  jac,
int *  rxn_int_data,
double *  rxn_float_data 
)

Update the time derivative and Jacbobian array indices.

Parameters
model_dataPointer to the model data
deriv_idsId of each state variable in the derivative array
jacJacobian
rxn_int_dataPointer to the reaction integer data
rxn_float_dataPointer to the reaction floating-point data

Definition at line 59 of file rxn_wet_deposition.c.

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