MMCollisionInt Class Reference

Calculation of Collision integrals. More...

#include <MMCollisionInt.h>

Public Member Functions
void	init (doublereal tsmin, doublereal tsmax, int loglevel=0)
	Initialize the object for calculation. More...
doublereal	omega22 (double ts, double deltastar)
doublereal	astar (double ts, double deltastar)
doublereal	bstar (double ts, double deltastar)
doublereal	cstar (double ts, double deltastar)
void	fit (int degree, doublereal deltastar, doublereal *astar, doublereal *bstar, doublereal *cstar)
void	fit_omega22 (int degree, doublereal deltastar, doublereal *om22)
doublereal	omega11 (double ts, double deltastar)

Private Member Functions
doublereal	fitDelta (int table, int ntstar, int degree, doublereal *c)

Private Attributes
std::vector< vector_fp >	m_o22poly
std::vector< vector_fp >	m_apoly
std::vector< vector_fp >	m_bpoly
std::vector< vector_fp >	m_cpoly
vector_fp	m_logTemp
	Log temp. More...
int	m_nmin
int	m_nmax
int	m_loglevel
	loglevel More...

Static Private Attributes
static doublereal	delta [8]
static doublereal	tstar22 [37]
static doublereal	omega22_table [37 *8]
	Table of omega22 values from MM. More...
static doublereal	tstar [39]
	table of tstar values More...
static doublereal	astar_table [39 *8]
	astar table from MM More...
static doublereal	bstar_table [39 *8]
	bstar table from MM More...
static doublereal	cstar_table [39 *8]
	cstar table from MM More...

Detailed Description

Calculation of Collision integrals.

This class provides functions that interpolate the tabulated collision integrals in Monchick and Mason, "Transport Properties of Polar Gases," J. Chem. Phys. (1961)

Definition at line 25 of file MMCollisionInt.h.

Constructor & Destructor Documentation

MMCollisionInt()

MMCollisionInt ( )

inline

Definition at line 28 of file MMCollisionInt.h.

~MMCollisionInt()

virtual ~MMCollisionInt ( )

inlinevirtual

Definition at line 29 of file MMCollisionInt.h.

Member Function Documentation

init()

void init	(	doublereal	tsmin,
		doublereal	tsmax,
		int	loglevel = 0
	)

Initialize the object for calculation.

Parameters

tsmin	Minimum value of Tstar to carry out the fitting
tsmax	Maximum value of Tstar to carry out the fitting
loglevel	Set the loglevel for the object. The default loglevel is zero, indicating no output.

Definition at line 218 of file MMCollisionInt.cpp.

References Cantera::debuglog(), MMCollisionInt::m_loglevel, MMCollisionInt::m_logTemp, MMCollisionInt::tstar, Cantera::vec2str(), Cantera::writelog(), and Cantera::writelogf().

Referenced by GasTransport::setupCollisionIntegral().

omega22()

doublereal omega22	(	double	ts,
		double	deltastar
	)

Definition at line 321 of file MMCollisionInt.cpp.

astar()

doublereal astar	(	double	ts,
		double	deltastar
	)

Definition at line 346 of file MMCollisionInt.cpp.

bstar()

doublereal bstar	(	double	ts,
		double	deltastar
	)

Definition at line 369 of file MMCollisionInt.cpp.

cstar()

doublereal cstar	(	double	ts,
		double	deltastar
	)

Definition at line 392 of file MMCollisionInt.cpp.

fit()

void fit	(	int	degree,
		doublereal	deltastar,
		doublereal *	astar,
		doublereal *	bstar,
		doublereal *	cstar
	)

Definition at line 438 of file MMCollisionInt.cpp.

fit_omega22()

void fit_omega22	(	int	degree,
		doublereal	deltastar,
		doublereal *	om22
	)

Definition at line 415 of file MMCollisionInt.cpp.

omega11()

doublereal omega11 ( double  ts, double  deltastar  )

inline

Definition at line 47 of file MMCollisionInt.h.

fitDelta()

doublereal fitDelta ( int  table, int  ntstar, int  degree, doublereal *  c  )

private

Definition at line 297 of file MMCollisionInt.cpp.

Member Data Documentation

m_o22poly

std::vector<vector_fp> m_o22poly

private

Definition at line 54 of file MMCollisionInt.h.

m_apoly

std::vector<vector_fp> m_apoly

private

Definition at line 55 of file MMCollisionInt.h.

m_bpoly

std::vector<vector_fp> m_bpoly

private

Definition at line 56 of file MMCollisionInt.h.

m_cpoly

std::vector<vector_fp> m_cpoly

private

Definition at line 57 of file MMCollisionInt.h.

delta

double delta

staticprivate

Initial value:

= {0.0, 0.25, 0.50, 0.75, 1.0,
                                   1.5, 2.0, 2.5
                                  }

Definition at line 59 of file MMCollisionInt.h.

tstar22

double tstar22

staticprivate

Initial value:

= {
    0.1, 0.2, 0.3, 0.4, 0.5, 0.6, 0.7, 0.8, 0.9, 1.0,
    1.2, 1.4, 1.6, 1.8, 2.0, 2.5, 3.0, 3.5, 4.0,
    5.0, 6.0, 7.0, 8.0, 9.0, 10.0, 12.0, 14.0, 16.0,
    18.0, 20.0, 25.0, 30.0, 35.0, 40.0, 50.0, 75.0, 100.0
}

Definition at line 60 of file MMCollisionInt.h.

omega22_table

double omega22_table

staticprivate

Table of omega22 values from MM.

Definition at line 63 of file MMCollisionInt.h.

tstar

double tstar

staticprivate

Initial value:

= {
    0.0, 0.1, 0.2, 0.3, 0.4, 0.5, 0.6, 0.7, 0.8, 0.9, 1.0,
    1.2, 1.4, 1.6, 1.8, 2.0, 2.5, 3.0, 3.5, 4.0,
    5.0, 6.0, 7.0, 8.0, 9.0, 10.0, 12.0, 14.0, 16.0,
    18.0, 20.0, 25.0, 30.0, 35.0, 40.0, 50.0, 75.0, 100.0, 500.0
}

table of tstar values

Definition at line 66 of file MMCollisionInt.h.

Referenced by MMCollisionInt::init().

astar_table

double astar_table

staticprivate

astar table from MM

Definition at line 69 of file MMCollisionInt.h.

bstar_table

double bstar_table

staticprivate

bstar table from MM

Definition at line 72 of file MMCollisionInt.h.

cstar_table

double cstar_table

staticprivate

cstar table from MM

Definition at line 75 of file MMCollisionInt.h.

m_logTemp

vector_fp m_logTemp

private

Log temp.

Definition at line 78 of file MMCollisionInt.h.

Referenced by MMCollisionInt::init().

m_nmin

int m_nmin

private

Definition at line 80 of file MMCollisionInt.h.

m_nmax

int m_nmax

private

Definition at line 81 of file MMCollisionInt.h.

m_loglevel

int m_loglevel

private

loglevel

Definition at line 84 of file MMCollisionInt.h.

Referenced by MMCollisionInt::init().

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

• MMCollisionInt.h
• MMCollisionInt.cpp