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Man Pages


Manual Reference Pages  -  SC_CARTESIANITER (3)

NAME

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

CONTENTS

Synopsis

SYNOPSIS

#include <cartiter.h>

Inherited by MPQC::CartesianIterCCA, sc::CartesianIterCCA, sc::CartesianIterCints, and sc::CartesianIterV3.

    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.

    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

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.

Author

Generated automatically by Doxygen for MPQC from the source code.

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Version 2.3.1 SC::CARTESIANITER (3) Sun Apr 3 2016

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