madness::xc_lda_potential Struct Reference

Compute the spin-restricted LDA potential using unaryop (only for the initial guess) More...

#include <xcfunctional.h>

Public Member Functions
	xc_lda_potential ()
void	operator() (const Key< 3 > &key, Tensor< double > &t) const

Detailed Description

Compute the spin-restricted LDA potential using unaryop (only for the initial guess)

Constructor & Destructor Documentation

xc_lda_potential()

madness::xc_lda_potential::xc_lda_potential ( )

inline

Member Function Documentation

operator()()

void madness::xc_lda_potential::operator() ( const Key< 3 > &  key, Tensor< double > &  t  ) const

inline

References madness::c_rks_vwn5__(), e(), madness::f, max, madness::Tensor< T >::ptr(), q(), madness::BaseTensor::size(), and madness::x_rks_s__().

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The documentation for this struct was generated from the following file:

• xcfunctional.h