mole_priv.h File Reference

#include "container_classes.h"

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Classes
class	GroupMap
class	mole_reaction

Namespaces
namespace	mole_priv

Macros
#define	MAXREACTANTS   3
#define	MAXPRODUCTS   4

Typedefs
typedef map< string, shared_ptr< mole_reaction > >::iterator	mole_reaction_i
typedef map< string, shared_ptr< mole_reaction > >::const_iterator	mole_reaction_ci
typedef map< string, shared_ptr< molecule > >::iterator	molecule_i
typedef map< string, shared_ptr< chem_element > >::iterator	chem_element_i

Enumerations
enum	udfastate { ABSENT , CORRECT , CONFLICT }

Functions
void	mole_eval_balance (long int n, double *b, bool lgJac, multi_arr< double, 2 > &c)
double	mole_solve (void)
void	mole_eval_sources (long int num_total)
realnum	mole_return_cached_species (const GroupMap &MoleMap)
double	frac_H2star_hminus ()
void	mole_update_rks (void)

Variables
map< string, shared_ptr< molecule > >	mole_priv::spectab
map< string, shared_ptr< mole_reaction > >	mole_priv::reactab
map< string, shared_ptr< chem_element > >	mole_priv::elemtab
map< string, shared_ptr< mole_reaction > >	mole_priv::functab
vector< molecule * >	groupspecies

Macro Definition Documentation

MAXPRODUCTS

#define MAXPRODUCTS   4

Referenced by compare_udfa(), parse_reaction(), and parse_udfa().

MAXREACTANTS

#define MAXREACTANTS   3

Referenced by compare_udfa(), mole_eval_balance(), mole_eval_sources(), parse_reaction(), and parse_udfa().

Typedef Documentation

chem_element_i

typedef map<string,shared_ptr<chem_element>>::iterator chem_element_i

mole_reaction_ci

typedef map<string,shared_ptr<mole_reaction>>::const_iterator mole_reaction_ci

mole_reaction_i

typedef map<string,shared_ptr<mole_reaction>>::iterator mole_reaction_i

molecule_i

typedef map<string,shared_ptr<molecule>>::iterator molecule_i

Enumeration Type Documentation

udfastate

enum udfastate

Enumerator
ABSENT
CORRECT
CONFLICT

Function Documentation

frac_H2star_hminus()

double frac_H2star_hminus ( )

extern

References h2, hmi, and SDIV().

Referenced by mole_h_rate_diagnostics().

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mole_eval_balance()

void mole_eval_balance ( long int n, double * b, bool lgJac, multi_arr< double, 2 > & c )

extern

mole_eval_balance

References ASSERT, DEBUG_ENTRY, fprintf(), mole_reaction::index, molecule::index, ioQQQ, mole_reaction::label, lgNucleiConserved(), MAXREACTANTS, mole, mole_global, mole_reaction::nproducts, mole_reaction::nreactants, NULL, mole_reaction::products, mole_reaction::pvector, mole_priv::reactab, mole_reaction::reactants, mole_reaction::rvector, trace, and multi_arr< T, d, ALLOC, lgBC >::zero().

Referenced by mole_eval_dynamic_balance().

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mole_eval_sources()

void mole_eval_sources ( long int num_total )

extern

References ASSERT, atmdat, molecule::charge, DEBUG_ENTRY, dense, mole_reaction::index, molecule::index, LIMELM, MAXREACTANTS, mole, molecule::nNuclide, mole_reaction::nproducts, mole_reaction::nreactants, nuclide_list, NULL, mole_reaction::products, mole_reaction::pvector, mole_priv::reactab, mole_reaction::reactants, and mole_reaction::rvector.

Referenced by mole_effects(), and mole_update_sources().

mole_return_cached_species()

realnum mole_return_cached_species ( const GroupMap & MoleMap )

extern

References ASSERT, dense, deut, frac(), lgElemsConserved(), mole, MOLE_ACTIVE, mole_global, NULL, and SDIV().

Referenced by mole_solve().

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mole_solve()

double mole_solve ( void )

extern

mole_solve fills in matrix for heavy elements molecular routines

References ASSERT, BIGFLOAT, check_co_ion_converge(), conv, DEBUG_ENTRY, dense, fixit, fnzone, fprintf(), funjac(), get_ptr(), groupspecies, hmi, ionbal, ioQQQ, ipHYDROGEN, lgElemsConserved(), mole, mole_global, mole_h_fixup(), mole_return_cached_species(), newton_step(), nuclide_list, nzone, phycon, GroupMap::setup(), trace, and GroupMap::updateMolecules().

Referenced by mole_drive().

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mole_update_rks()

void mole_update_rks ( void )

extern

mole_update_rks update rate coefficients, only temp part

References mole_reaction::a, DEBUG_ENTRY, fprintf(), mole_reaction::index, ioQQQ, mole_reaction::label, mole, mole_h2_grain_form(), mole_h_reactions(), mole_priv::reactab, and mole_reaction::rk().

Referenced by mole_drive().

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Variable Documentation

groupspecies

vector<molecule *> groupspecies

extern

Referenced by funjac(), grouped_elems(), mole_make_groups(), mole_solve(), mole_system_error(), newton_step(), GroupMap::setup(), and GroupMap::updateMolecules().