sc::SOTransform(3)

NAME
sc::SOTransform - SOTransform maintains a list of AO shells that are be used to compute the SO.

SYNOPSIS

#include <sobasis.h>

  Public Methods
SOTransform ()
~SOTransform ()
void set_naoshell (int n)
void add_transform (int aoshell, int irrep, double coef, int aofunc, int sofunc)
Adds another term to the transform.

  Public Attributes
int naoshell_allocated
int naoshell
The number of AO shells that make up this SO shell.
SOTransformShell * aoshell
The SOTransformShell object for each AO.

DETAILED DESCRIPTION

SOTransform maintains a list of AO shells that are be used to compute the SO.

The information is stored in objects of type SOTransformShell.

AUTHOR

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