ampsci
c++ program for high-precision atomic structure calculations of single-valence systems
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DiracODE::AsymptoticSpinor< Nx >

Performs asymptotic expansion for f and g at large r, up to order Nx in (1/r) More...

#include <AsymptoticSpinor.hpp>

Public Member Functions

 AsymptoticSpinor (int in_kappa, double in_Zeff, double in_en, double in_alpha=PhysConst::alpha, double in_eps_target=1.0e-14, double m=1.0)
 
std::pair< double, double > fg (double r) const
 Performs asymptotic expansion for f and g at large r, up to order Nx in (1/r) More...
 

Detailed Description

template<std::size_t Nx = 15>
class DiracODE::AsymptoticSpinor< Nx >

Performs asymptotic expansion for f and g at large r, up to order Nx in (1/r)

Member Function Documentation

◆ fg()

template<std::size_t Nx = 15>
std::pair<double, double> DiracODE::AsymptoticSpinor< Nx >::fg ( double  r) const
inline

Performs asymptotic expansion for f and g at large r, up to order Nx in (1/r)

Large-r expansion of upper/lower radial components of the Dirac solution, see Johnson (2007), Eqs. (2.170) – (2.171).

f(r) = r^s exp(-yr) * { A(1 + O(1/r) + ...) + B(O(1/r) + ...)},

g(r) = r^s exp(-yr) * { -B(1 + O(1/r) + ...) + A(O(1/r) + ...)},

where s~1, y~1, A~1, B<<1.

It's the 1/r expansion inside the {} brackets that is truncated at order Nx. The series is terminated if relative change drops below eps_target. This usually hapens around order ~5.


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