sc_VWN5LCFunctional (3) - Linux Man Pages

NAME

sc::VWN5LCFunctional -

The VWN5LCFunctional computes energies and densities using the VWN5 local correlation term (from Vosko, Wilk, and Nusair).

SYNOPSIS


#include <functional.h>

Inherits sc::VWNLCFunctional.

Public Member Functions


VWN5LCFunctional (const Ref< KeyVal > &)

VWN5LCFunctional (StateIn &)

void save_data_state (StateOut &)
Save the base classes (with save_data_state) and the members in the same order that the StateIn CTOR initializes them.
void point_lc (const PointInputData &, PointOutputData &, double &, double &, double &)

Detailed Description

The VWN5LCFunctional computes energies and densities using the VWN5 local correlation term (from Vosko, Wilk, and Nusair).

Member Function Documentation

void sc::VWN5LCFunctional::save_data_state (StateOut &) [virtual]

Save the base classes (with save_data_state) and the members in the same order that the StateIn CTOR initializes them. This must be implemented by the derived class if the class has data.

Reimplemented from sc::VWNLCFunctional.

Author

Generated automatically by Doxygen for MPQC from the source code.