MPQC 2.3.1

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Public Member Functions | Public Attributes
sc::SOTransform Class Reference

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

`#include <sobasis.h>`

List of all members.

## Public Member Functions

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.

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

- sobasis.h