Guess Struct Reference

Inheritance diagram for Guess:

Collaboration diagram for Guess:

Public Member Functions
	Guess (double Z)
	Guess (double z, double exponent, int nx, int ny, int nz)
double	operator() (const coord_3d &r) const
double_complex	operator() (const coordT &r) const
Level	special_level () const
std::vector< coord_3d >	special_points () const
	Override this to return list of special points to be refined more deeply.
Public Member Functions inherited from madness::FunctionFunctorInterface< double, 3 >
	FunctionFunctorInterface ()
virtual	~FunctionFunctorInterface ()
virtual coeffT	coeff (const keyT &) const
virtual void	operator() (const Vector< double *, 1 > &xvals, double *fvals, int npts) const
virtual void	operator() (const Vector< double *, 2 > &xvals, double *fvals, int npts) const
virtual void	operator() (const Vector< double *, 3 > &xvals, double *fvals, int npts) const
virtual void	operator() (const Vector< double *, 4 > &xvals, double *fvals, int npts) const
virtual void	operator() (const Vector< double *, 5 > &xvals, double *fvals, int npts) const
virtual void	operator() (const Vector< double *, 6 > &xvals, double *fvals, int npts) const
virtual double	operator() (const Vector< double, NDIM > &x) const=0
	You should implement this to return f(x)
virtual bool	provides_coeff () const
	does this functor directly provide sum coefficients? or only function values?
virtual bool	screened (const Vector< double, NDIM > &c1, const Vector< double, NDIM > &c2) const
	Can we screen this function based on the bounding box information?
void	set_length_scale (double lo)
	adapt the special level to resolve the smallest length scale
virtual Level	special_level ()
	Override this change level refinement for special points (default is 6)
virtual bool	supports_vectorized () const
	Does the interface support a vectorized operator()?
virtual coeffT	values (const keyT &key, const Tensor< double > &tensor) const
Public Member Functions inherited from madness::FunctionFunctorInterface< double_complex, 3 >
	FunctionFunctorInterface ()
virtual	~FunctionFunctorInterface ()
virtual coeffT	coeff (const keyT &) const
virtual void	operator() (const Vector< double *, 1 > &xvals, double_complex *fvals, int npts) const
virtual void	operator() (const Vector< double *, 2 > &xvals, double_complex *fvals, int npts) const
virtual void	operator() (const Vector< double *, 3 > &xvals, double_complex *fvals, int npts) const
virtual void	operator() (const Vector< double *, 4 > &xvals, double_complex *fvals, int npts) const
virtual void	operator() (const Vector< double *, 5 > &xvals, double_complex *fvals, int npts) const
virtual void	operator() (const Vector< double *, 6 > &xvals, double_complex *fvals, int npts) const
virtual double_complex	operator() (const Vector< double, NDIM > &x) const=0
	You should implement this to return f(x)
virtual bool	provides_coeff () const
	does this functor directly provide sum coefficients? or only function values?
virtual bool	screened (const Vector< double, NDIM > &c1, const Vector< double, NDIM > &c2) const
	Can we screen this function based on the bounding box information?
void	set_length_scale (double lo)
	adapt the special level to resolve the smallest length scale
virtual Level	special_level ()
	Override this change level refinement for special points (default is 6)
virtual bool	supports_vectorized () const
	Does the interface support a vectorized operator()?
virtual coeffT	values (const keyT &key, const Tensor< double > &tensor) const

Public Attributes
const double	exponent
const int	nx
const int	ny
const int	nz
const double	z
Public Attributes inherited from madness::FunctionFunctorInterface< double, 3 >
Level	special_level_
Public Attributes inherited from madness::FunctionFunctorInterface< double_complex, 3 >
Level	special_level_

Private Attributes
const double	fac
std::vector< coord_3d >	specialpt
const double	v
const double	Z

Additional Inherited Members
Public Types inherited from madness::FunctionFunctorInterface< double, 3 >
typedef GenTensor< double >	coeffT
typedef Key< NDIM >	keyT
typedef double	value_type
Public Types inherited from madness::FunctionFunctorInterface< double_complex, 3 >
typedef GenTensor< double_complex >	coeffT
typedef Key< NDIM >	keyT
typedef double_complex	value_type

Constructor & Destructor Documentation

Guess() [1/2]

Guess::Guess ( double  Z )

inline

Guess() [2/2]

Guess::Guess ( double  z, double  exponent, int  nx, int  ny, int  nz  )

inline

Member Function Documentation

operator()() [1/2]

double Guess::operator() ( const coord_3d &  r ) const

inline

References fac, op_dx, pow(), R, v, Z, and z.

operator()() [2/2]

double_complex Guess::operator() ( const coordT &  r ) const

inline

References exponent, nx, ny, nz, psi(), and z.

special_level()

Level Guess::special_level ( ) const

inline

special_points()

std::vector< coord_3d > Guess::special_points ( ) const

inlinevirtual

Override this to return list of special points to be refined more deeply.

Reimplemented from madness::FunctionFunctorInterface< double, 3 >.

References specialpt.

Member Data Documentation

exponent

const double Guess::exponent

Referenced by operator()().

fac

const double Guess::fac

private

Referenced by operator()().

nx

const int Guess::nx

Referenced by operator()().

ny

const int Guess::ny

Referenced by operator()().

nz

const int Guess::nz

Referenced by operator()().

specialpt

std::vector<coord_3d> Guess::specialpt

private

Referenced by special_points().

v

const double Guess::v

private

Referenced by operator()().

Z

const double Guess::Z

private

Referenced by operator()().

z

const double Guess::z

Referenced by operator()(), and operator()().

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

• rk.cc
• vnucso.cc