Manual Reference Pages - SC_BECKE88XFUNCTIONAL (3)
sc::Becke88XFunctional - Implements Beckes 1988 exchange functional.
Public Member Functions
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 &)
Additional Inherited Members
Implements Beckes 1988 exchange functional.
A. D. Becke, Phys. Rev. A, 38(6), pp. 3098-3100, 1988.
Member Function Documentation
void sc::Becke88XFunctional::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::DenFunctional.
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|Version 2.3.1 ||SC::BECKE88XFUNCTIONAL (3) ||Sun Apr 3 2016 |
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