man sc_SOTransformFunction (Fonctions bibliothèques) - SOTransformShell describes how an AO function contributes to an SO function in a particular SO shell.

NAME

sc::SOTransformFunction - SOTransformShell describes how an AO function contributes to an SO function in a particular SO shell.

SYNOPSIS



#include <sobasis.h>

Public Attributes

double coef

The coefficient of the AO. int aofunc

The AO function number. int sofunc

The SO function number. int irrep

The SO function's irrep.

Detailed Description

SOTransformShell describes how an AO function contributes to an SO function in a particular SO shell.

Author

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