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sc::Becke88XFunctional(3) MPQC sc::Becke88XFunctional(3)

sc::Becke88XFunctional - Implements Becke's 1988 exchange functional.

#include <functional.h>

Inherits sc::DenFunctional.


Becke88XFunctional (const Ref< KeyVal > &)
Becke88XFunctional (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. int need_density_gradient ()
void point (const PointInputData &, PointOutputData &)


double beta_
double beta6_

Implements Becke's 1988 exchange functional.

A. D. Becke, Phys. Rev. A, 38(6), pp. 3098-3100, 1988.

Reimplemented from sc::DenFunctional.

Implements sc::DenFunctional.

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::DenFunctional.

Generated automatically by Doxygen for MPQC from the source code.
Tue Jun 7 2022 Version 2.3.1

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