Wrapper class for 'CVODE' integrator from LLNL. More...

#include <CVodeInt.h>

Inheritance diagram for CVodeInt:

Collaboration diagram for CVodeInt:

Public Member Functions
	CVodeInt ()

virtual void	setTolerances (double reltol, size_t n, double *abstol)
	Set or reset the number of equations. More...

virtual void	setTolerances (double reltol, double abstol)
	Set error tolerances. More...

virtual void	setProblemType (int probtype)
	Set the problem type. More...

virtual void	initialize (double t0, FuncEval &func)
	Initialize the integrator for a new problem. More...

virtual void	reinitialize (double t0, FuncEval &func)

virtual void	integrate (double tout)
	Integrate the system of equations. More...

virtual doublereal	step (double tout)
	Integrate the system of equations. More...

virtual double &	solution (size_t k)
	The current value of the solution of equation k. More...

virtual double *	solution ()
	The current value of the solution of the system of equations. More...

virtual int	nEquations () const
	The number of equations. More...

virtual int	nEvals () const
	The number of function evaluations. More...

virtual void	setMaxOrder (int n)
	Set the maximum integration order that will be used. More...

virtual void	setMethod (MethodType t)
	Set the solution method. More...

virtual void	setIterator (IterType t)
	Set the linear iterator. More...

virtual void	setMaxStepSize (double hmax)
	Set the maximum step size. More...

virtual void	setMinStepSize (double hmin)
	Set the minimum step size. More...

virtual void	setMaxSteps (int nmax)

virtual void	setMaxErrTestFails (int nmax)
	Set the maximum permissible number of error test failures. More...

Public Member Functions inherited from Integrator
	Integrator ()
	Default Constructor. More...

virtual	~Integrator ()
	Destructor. More...

virtual void	setSensitivityTolerances (doublereal reltol, doublereal abstol)
	Set the sensitivity error tolerances. More...

virtual void	setBandwidth (int N_Upper, int N_Lower)

virtual int	nSensParams ()

virtual double	sensitivity (size_t k, size_t p)

Private Attributes
int	m_neq

void *	m_cvode_mem

double	m_t0

N_Vector	m_y

N_Vector	m_abstol

int	m_type

int	m_itol

int	m_method

int	m_iter

int	m_maxord

double	m_reltol

double	m_abstols

int	m_nabs

double	m_hmax

double	m_hmin

int	m_maxsteps

vector_fp	m_ropt

long int *	m_iopt

void *	m_data

Detailed Description

Wrapper class for 'CVODE' integrator from LLNL.

The unmodified CVODE code is in directory ext/cvode.

See Also: FuncEval.h. Classes that use CVodeInt: ImplicitChem, ImplicitSurfChem, Reactor

Definition at line 34 of file CVodeInt.h.

Constructor & Destructor Documentation

CVodeInt ( )

Constructor. Default settings: dense Jacobian, no user-supplied Jacobian function, Newton iteration.

Definition at line 79 of file CVodeInt.cpp.

Member Function Documentation

void setTolerances	(	double	reltol,
		size_t	n,
		double *	abstol
	)

virtual

Set or reset the number of equations.

Set error tolerances.

Parameters

reltol	scalar relative tolerance
n	Number of equations
abstol	array of N absolute tolerance values

Reimplemented from Integrator.

Definition at line 123 of file CVodeInt.cpp.

void setTolerances	(	double	reltol,
		double	abstol
	)

virtual

Set error tolerances.

Parameters

reltol	scalar relative tolerance
abstol	scalar absolute tolerance

Reimplemented from Integrator.

Definition at line 139 of file CVodeInt.cpp.

void setProblemType ( int probtype )

virtual

Set the problem type.

Parameters

probtype Type of the problem

Reimplemented from Integrator.

Definition at line 146 of file CVodeInt.cpp.

void initialize	(	double	t0,
		FuncEval &	func
	)

virtual

Initialize the integrator for a new problem.

Call after all options have been set.

Parameters

t0	initial time
func	RHS evaluator object for system of equations.

Reimplemented from Integrator.

Definition at line 191 of file CVodeInt.cpp.

References cvode_jac(), cvode_rhs(), DATA_PTR, FuncEval::getInitialConditions(), and FuncEval::neq().

void integrate ( double tout )

virtual

Integrate the system of equations.

Parameters

tout	Integrate to this time. Note that this is the absolute time value, not a time interval.

Reimplemented from Integrator.

Definition at line 291 of file CVodeInt.cpp.

References Cantera::int2str().

double step ( double tout )

virtual

Integrate the system of equations.

Parameters

tout	integrate to this time. Note that this is the absolute time value, not a time interval.

Reimplemented from Integrator.

Definition at line 301 of file CVodeInt.cpp.

References Cantera::int2str().

double & solution ( size_t k )

virtual

The current value of the solution of equation k.

Reimplemented from Integrator.

Definition at line 114 of file CVodeInt.cpp.

double * solution ( )

virtual

The current value of the solution of the system of equations.

Reimplemented from Integrator.

Definition at line 118 of file CVodeInt.cpp.

virtual int nEquations ( ) const

inlinevirtual

The number of equations.

Reimplemented from Integrator.

Definition at line 52 of file CVodeInt.h.

int nEvals ( ) const

virtual

The number of function evaluations.

Reimplemented from Integrator.

Definition at line 312 of file CVodeInt.cpp.

virtual void setMaxOrder ( int n )

inlinevirtual

Set the maximum integration order that will be used.

Reimplemented from Integrator.

Definition at line 56 of file CVodeInt.h.

void setMethod ( MethodType t )

virtual

Set the solution method.

Reimplemented from Integrator.

Definition at line 151 of file CVodeInt.cpp.

References Cantera::Adams_Method, and Cantera::BDF_Method.

void setIterator ( IterType t )

virtual

Set the linear iterator.

Reimplemented from Integrator.

Definition at line 180 of file CVodeInt.cpp.

References Cantera::Functional_Iter, and Cantera::Newton_Iter.

void setMaxStepSize ( double hmax )

virtual

Set the maximum step size.

Reimplemented from Integrator.

Definition at line 162 of file CVodeInt.cpp.

void setMinStepSize ( double hmin )

virtual

Set the minimum step size.

Reimplemented from Integrator.

Definition at line 168 of file CVodeInt.cpp.

virtual void setMaxErrTestFails ( int n )

inlinevirtual

Set the maximum permissible number of error test failures.

Reimplemented from Integrator.

Definition at line 64 of file CVodeInt.h.

The documentation for this class was generated from the following files:

Public Member Functions

Private Attributes

Detailed Description

Constructor & Destructor Documentation

Member Function Documentation