FermiNucDistFunctor Class Reference

Inheritance diagram for FermiNucDistFunctor:

Collaboration diagram for FermiNucDistFunctor:

Public Member Functions
	FermiNucDistFunctor (int &Z, coord_3d R, double bohr_rad)
double	operator() (const coord_3d &r) const
void	print_details (World &world)
madness::Level	special_level ()
	Override this change level refinement for special points (default is 6)
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 bool	supports_vectorized () const
	Does the interface support a vectorized operator()?
virtual coeffT	values (const keyT &key, const Tensor< double > &tensor) const

Private Attributes
int	m_A
double	m_C
std::vector< coord_3d >	m_R
double	m_T

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

Constructor & Destructor Documentation

FermiNucDistFunctor()

FermiNucDistFunctor::FermiNucDistFunctor ( int &  Z, coord_3d  R, double  bohr_rad  )

inline

References m_A, m_C, m_R, m_T, PI, madness::constants::pi, pow(), R, and Z.

Member Function Documentation

operator()()

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

inline

References m_C, m_R, and m_T.

print_details()

void FermiNucDistFunctor::print_details ( World &  world )

inline

References PI, madness::constants::pi, pow(), madness::World::rank(), T(), and xi.

special_level()

madness::Level FermiNucDistFunctor::special_level ( )

inlinevirtual

Override this change level refinement for special points (default is 6)

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

special_points()

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

inlinevirtual

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

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

References m_R.

Member Data Documentation

m_A

int FermiNucDistFunctor::m_A

private

Referenced by FermiNucDistFunctor().

m_C

double FermiNucDistFunctor::m_C

private

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

m_R

std::vector<coord_3d> FermiNucDistFunctor::m_R

private

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

m_T

double FermiNucDistFunctor::m_T

private

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

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

• DF.cc