sc_SphericalTransformComponentCints (3) - Linux Manuals


sc::SphericalTransformComponentCints -


Inherits sc::SphericalTransformComponent.

Public Member Functions

void init (int a, int b, int c, double coef, int pureindex)
Initialize this object.

Member Function Documentation

void sc::SphericalTransformComponentCints::init (int a, int b, int c, double coef, int pureindex) [inline, virtual]

Initialize this object. This must be provided in all specializations of this class to establish the ordering between a, b and c and the index of the Cartesian basis function. Other things such as adjustment of the coefficient to account for normalization differences can be done as well. The default SphericalTransform::init() implementation requires that only the xl , yl and zl basis functions are normalized to unity.

Implements sc::SphericalTransformComponent.


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