QCPm3 Class Reference

#include <QCPm3.hpp>

Inheritance diagram for QCPm3:

Inheritance graph
[legend]
List of all members.

Detailed Description

Class of the semi-empirical quantum model .PM3.

Class of the semi-empirical quantum model PM3 :
Parametric Method number 3. Historally, this model is an evolution of MNDO.
Hence, in the oriented object QC++ analysis, it appears like a derivated class
of CQCMndo. PM3 is just a different parametrization of AM1, but it's
the same set of equations.

Definition at line 36 of file QCPm3.hpp.

Public Member Functions

 QCPm3 (const int &nbAOsp, const int &nbAOspd)
virtual ~QCPm3 (void)


Constructor & Destructor Documentation

QCPm3::QCPm3 const int &  nbAOsp,
const int &  nbAOspd
 

Definition at line 29 of file QCPm3.cpp.

QCPm3::~QCPm3 void   )  [virtual]
 

Definition at line 39 of file QCPm3.cpp.


The documentation for this class was generated from the following files:
Generated on Sat Jan 28 21:07:34 2006 for QC++ by  doxygen 1.4.4