TI_INTEGRATION_INFO Struct Reference

#include <run_control.h>

List of all members.

Public Attributes
double	KLAMBDA
	The value of klambda. Typically integral, but might float...
char *	CLAMBDA_HOW
	Method for assigning CLAMBDA's. Not necessarily the same as the integration technique (see ANALYZE_HOW)
char *	POINTSFILE
	If CLAMBDA_HOW involves reading a file, this is the file to read.
int	nCLAMBDA
	The number of CLAMBDA values.
double *	CLAMBDA
	The CLAMBDA values.
int	nWIDTHS
	Should equal nCLAMBDA or zero -- here to facilitate checks to see if widths are defined.
double *	WIDTHS
	Widths to assign to each CLAMBDA value (e.g., for GAUSSIAN quadrature)
char *	ANALYZE_HOW
	The numerical integration method to use.

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Detailed Description

This will be used generally for TI calcs. Contains information about how the TI integration is to be carried out. Information includes beginning and end of run information. For example, it contains the lambda values to use as well as the manner in which they should be integrated once the data are collected.

Definition at line 46 of file run_control.h.

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Member Data Documentation

char* TI_INTEGRATION_INFO::ANALYZE_HOW

The numerical integration method to use.

Definition at line 56 of file run_control.h.

double* TI_INTEGRATION_INFO::CLAMBDA

The CLAMBDA values.

Definition at line 53 of file run_control.h.

char* TI_INTEGRATION_INFO::CLAMBDA_HOW

Method for assigning CLAMBDA's. Not necessarily the same as the integration technique (see ANALYZE_HOW)

Definition at line 48 of file run_control.h.

double TI_INTEGRATION_INFO::KLAMBDA

The value of klambda. Typically integral, but might float...

Definition at line 47 of file run_control.h.

int TI_INTEGRATION_INFO::nCLAMBDA

The number of CLAMBDA values.

Definition at line 52 of file run_control.h.

int TI_INTEGRATION_INFO::nWIDTHS

Should equal nCLAMBDA or zero -- here to facilitate checks to see if widths are defined.

Definition at line 54 of file run_control.h.

char* TI_INTEGRATION_INFO::POINTSFILE

If CLAMBDA_HOW involves reading a file, this is the file to read.

Definition at line 51 of file run_control.h.

double* TI_INTEGRATION_INFO::WIDTHS

Widths to assign to each CLAMBDA value (e.g., for GAUSSIAN quadrature)

Definition at line 55 of file run_control.h.

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The documentation for this struct was generated from the following file:

• inc/AMBER/run_control.h