sc_VWN3LCFunctional (3) - Linux Man Pages
Public Member Functions
VWN3LCFunctional (int mcp=1, int mce0=1)
VWN3LCFunctional (const Ref< KeyVal > &)
VWN3LCFunctional (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 &)
The VWN3LCFunctional computes energies and densities using the VWN3 local correlation term (from Vosko, Wilk, and Nusair).
Member Function Documentation
void sc::VWN3LCFunctional::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.
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