MPQC  2.3.1
Protected Member Functions | List of all members
sc::ISphericalTransform Class Reference

This describes a solid harmonic to Cartesian transform. More...

#include <transform.h>

Inheritance diagram for sc::ISphericalTransform:
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Protected Member Functions

 ISphericalTransform (int l, int subl=-1)
 
void init ()
 This determines all of the components of the transformation. More...
 
- Protected Member Functions inherited from sc::SphericalTransform
 SphericalTransform (int l, int subl=-1)
 This constructs the SphericalTransform for the given Cartesian angular momentum l and solid harmonic angular momentum subl. More...
 

Additional Inherited Members

- Public Member Functions inherited from sc::SphericalTransform
void add (int a, int b, int c, double coef, int pureindex)
 Adds another SphericalTransformComponent.
 
int cartindex (int i) const
 Returns the Cartesian basis function index of component i.
 
int pureindex (int i) const
 Returns the solid harmonic basis function index of component i.
 
double coef (int i) const
 Returns the transform coefficient of component i.
 
int a (int i) const
 Returns the Cartesian basis function's x exponent of component i.
 
int b (int i) const
 Returns the Cartesian basis function's y exponent of component i.
 
int c (int i) const
 Returns the Cartesian basis function's z exponent of component i.
 
int l () const
 Returns the angular momentum.
 
int n () const
 Returns the number of components in the transformation.
 
virtual SphericalTransformComponentnew_components ()=0
 This must create SphericalTransformComponent's of the appropriate specialization.
 
- Protected Attributes inherited from sc::SphericalTransform
int n_
 
int l_
 
int subl_
 
SphericalTransformComponentcomponents_
 

Detailed Description

This describes a solid harmonic to Cartesian transform.

Member Function Documentation

◆ init()

void sc::ISphericalTransform::init ( )
protectedvirtual

This determines all of the components of the transformation.

It should be possible to implement the SphericalTransformComponent::init specialization in such a way that the default SphericalTransform::init can be used.

Reimplemented from sc::SphericalTransform.


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

Generated at Sun Jan 26 2020 23:33:07 for MPQC 2.3.1 using the documentation package Doxygen 1.8.16.