sgl_guess Struct Reference

Public Member Functions
	sgl_guess (const long n, const long l, const long m, const double Z)
double	energy () const
complex_function_3d	get_wf (World &world) const
double_complex	operator() (const coord_3d &coord) const

Public Attributes
long	l
long	m
long	n
double	Z

Constructor & Destructor Documentation

sgl_guess()

sgl_guess::sgl_guess ( const long  n, const long  l, const long  m, const double  Z  )

inline

Member Function Documentation

energy()

double sgl_guess::energy ( ) const

inline

References Z.

get_wf()

complex_function_3d sgl_guess::get_wf ( World &  world ) const

inline

References madness::detail::norm(), madness::Function< T, NDIM >::norm2(), and madness::Function< T, NDIM >::scale().

operator()()

double_complex sgl_guess::operator() ( const coord_3d &  coord ) const

inline

References e(), generalized_laguerre(), m, madness::Vector< T, N >::normf(), pow(), R, and Z.

Member Data Documentation

l

long sgl_guess::l

m

long sgl_guess::m

n

long sgl_guess::n

Z

double sgl_guess::Z

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

• dirac-hatom.cc