RadialSchemeTurbo Struct Reference

#include <grid_atomic.h>

Inheritance diagram for RadialSchemeTurbo:

Public Member Functions
	RadialSchemeTurbo ()
virtual void	init (int myNumber, int charge, real threshold)
	This quadrature follows [JCP 102, 346 (1995)]. More...
virtual void	generate (real *r, real *w)
	Actual generation of the radial quadrature. More...
Public Member Functions inherited from RadialScheme
	RadialScheme (const char *n)
int	size () const
virtual	~RadialScheme ()

Public Attributes
real	zeta
Public Attributes inherited from RadialScheme
const char *	name
int	gridSize

Constructor & Destructor Documentation

RadialSchemeTurbo::RadialSchemeTurbo ( )

inline

References charge, RadialScheme::generate(), and RadialScheme::init().

Member Function Documentation

void RadialSchemeTurbo::generate ( real *  r, real *  w  )

virtual

Actual generation of the radial quadrature.

Implements RadialScheme.

References RadialScheme::gridSize.

void RadialSchemeTurbo::init ( int  myNumber, int  Z, real  thrl  )

virtual

This quadrature follows [JCP 102, 346 (1995)].

That is T2 quadrature with M4 mapping of r.

Implements RadialScheme.

References RadialScheme::gridSize.

Member Data Documentation

real RadialSchemeTurbo::zeta

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

• source/dft/grid_atomic.h
• source/dft/grid_atomic.cc