sc_PointOutputData man page

sc::PointOutputData — Contains data generated at each point by a DenFunctional.

Synopsis

#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.

Author

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Info

Fri May 6 2016 Version 2.3.1 MPQC