sc::SOTransformShell Class Reference

SOTransformShell maintains a list of AO functions contribute to an SO function in a particular SO shell. More...

#include <chemistry/qc/basis/sobasis.h>

Public Member Functions
void	add_func (int irrep, double coef, int aofunc, int sofunc)
	Add another function to the transform.

Public Attributes
int	aoshell
	The number of the AO shell from which these functions come.
int	nfunc
	The number of AO/SO function pairs contributing.
SOTransformFunction *	func
	The array of SOTransformFunction objects describing the transform.

Detailed Description

SOTransformShell maintains a list of AO functions contribute to an SO function in a particular SO shell.

The information is stored in objects of type SOTransformFunction.

---

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

• src/lib/chemistry/qc/basis/sobasis.h