Class to compute the energy functional. More...
#include <xcfunctional.h>
Collaboration diagram for xc_functional:
Public Member Functions | |
| xc_functional (const XCfunctional &xc, int ispin) | |
| madness::Tensor< double > | operator() (const madness::Key< 3 > &key, const std::vector< madness::Tensor< double > > &t) const |
Public Attributes | |
| const XCfunctional * | xc |
| const int | ispin |
Detailed Description
Class to compute the energy functional.
Constructor & Destructor Documentation
|
inline |
Member Function Documentation
|
inline |
References XCfunctional::exc().
Member Data Documentation
| const int xc_functional::ispin |
| const XCfunctional* xc_functional::xc |
The documentation for this struct was generated from the following file:
