MPQC  2.3.1
Public Member Functions | Public Attributes | List of all members
sc::PointOutputData Struct Reference

Contains data generated at each point by a DenFunctional. More...

#include <functional.h>

Public Member Functions

void zero ()
 

Public Attributes

double energy
 
double df_drho_a
 
double df_drho_b
 
double df_dgamma_aa
 
double df_dgamma_bb
 
double df_dgamma_ab
 

Detailed Description

Contains data generated at each point by a DenFunctional.


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

Generated at Sun Jan 26 2020 23:33:07 for MPQC 2.3.1 using the documentation package Doxygen 1.8.16.