sparse_pattern.h File Reference

Class that can be used to store sparse matrix patterns. More...

#include <vector>
#include <stdio.h>
#include "basisinfo.h"

Go to the source code of this file.

Classes
class	SparsePattern
	A way to store sparse matrix patterns. More...
struct	SparsePattern::Interval
	ranges are upper-exclusive: involve i: lo <= i < hi. More...
struct	SparsePattern::Column
struct	SparsePattern::Column::Iterator

Macros
#define	BEGIN_NAMESPACE(x)
#define	END_NAMESPACE(x)

Functions
void	setupShellMap (const BasisInfoStruct &bis, int *shellMap, int *aoMap)

Detailed Description

Class that can be used to store sparse matrix patterns.

Author

: Pawel Salek responsible

Macro Definition Documentation

BEGIN_NAMESPACE

#define BEGIN_NAMESPACE

(

x

)

Value:

namespace x {

END_NAMESPACE

#define END_NAMESPACE

(

x

)

Value:

} /* x */

Function Documentation

setupShellMap()

void setupShellMap	(	const BasisInfoStruct &	bis,
		int *	shellMap,
		int *	aoMap )

References SparsePattern::bis, ShellSpecStruct::centerCoords, clusterShells(), Box::hi, Box::lo, BasisInfoStruct::noOfShells, prepareAOMap(), and BasisInfoStruct::shellList.