MADNESS  0.10.1
Public Member Functions | Public Attributes | List of all members
madness::CISData Struct Reference

POD for CIS excitation. More...

#include <PNOStructures.h>

Public Member Functions

 CISData ()
 
 CISData (const size_t &n, const double &o, const vector_real_function_3d &f)
 
bool initialized () const
 

Public Attributes

vector_real_function_3d Kx =vector_real_function_3d()
 
int number =-1
 
double omega =0.0
 
vector_real_function_3d Vx =vector_real_function_3d()
 
vector_real_function_3d x =vector_real_function_3d()
 

Detailed Description

POD for CIS excitation.

Constructor & Destructor Documentation

◆ CISData() [1/2]

madness::CISData::CISData ( )
inline

◆ CISData() [2/2]

madness::CISData::CISData ( const size_t &  n,
const double &  o,
const vector_real_function_3d f 
)
inline

Member Function Documentation

◆ initialized()

bool madness::CISData::initialized ( ) const
inline

References number, omega, and x.

Referenced by madness::PNOPairs::is_consistent().

Member Data Documentation

◆ Kx

◆ number

int madness::CISData::number =-1

◆ omega

double madness::CISData::omega =0.0

◆ Vx

◆ x


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