sc::CartesianIter Class Reference

CartesianIter gives the ordering of the Cartesian functions within a shell for the particular integrals specialization. More...

#include <chemistry/qc/basis/cartiter.h>

Inheritance diagram for sc::CartesianIter:

Public Member Functions
	CartesianIter (int l)
	Initialize an iterator for the given angular momentum.
virtual void	start ()=0
	Start the iteration.
virtual void	next ()=0
	Move to the next Cartesian function.
virtual	operator int ()=0
	Returns nonzero if the iterator currently hold valid data.
int	n ()
	Returns the number of Cartesian functions.
int	a ()
	Returns the exponent of x.
int	b ()
	Returns the exponent of y.
int	c ()
	Returns the exponent of z.
int	l ()
	Returns the angular momentum.
int	l (int i)
	Returns a() if i==0, b() if i==1, and c() if i==2.
int	bfn ()
	Returns the number of the current basis function within the shell. More...

Protected Attributes
int	a_
int	b_
int	c_
int	l_
int	bfn_

Detailed Description

CartesianIter gives the ordering of the Cartesian functions within a shell for the particular integrals specialization.

Member Function Documentation

bfn()

int sc::CartesianIter::bfn ( )

inline

Returns the number of the current basis function within the shell.

This starts at 0 and sequentially increases as next() is called.

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

• src/lib/chemistry/qc/basis/cartiter.h