Hex  2.2
Hydrogen-electron collision solver
potential.h
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31 
32 #ifndef HEX_DISTORTING_POTENTIAL
33 #define HEX_DISTORTING_POTENTIAL
34 
35 #include "hex-arrays.h"
36 #include "hex-hydrogen.h"
37 #include "hex-special.h"
38 
54 extern const rArrays Ucoeffs;
55 
86 class DistortingPotential : public special::RadialFunction<double>
87 {
88 public:
89  // constructors
90  // @{
91  DistortingPotential() : n_(0), k_(0.), rmax_(0) {}
92  DistortingPotential(int n, double rmax = 0.) : n_(n), k_(0.), rmax_(rmax) {}
93  DistortingPotential(double k, double rmax = 0.) : n_(0), k_(k), rmax_(rmax) {}
94  DistortingPotential(DistortingPotential const & U) : n_(U.n_), k_(U.k_), rmax_(U.rmax_) {}
95  // @}
96 
101 
105  bool operator== (DistortingPotential const & V) const;
106 
118  double operator() (double x) const;
119 
126  double getTurningPoint () const { return 0.; }
127 
136  std::pair<double,int> getZeroAsymptotic (double x) const { return std::make_pair(-1,-1); }
137 
147  double plusMonopole(double x) const;
148 
157  double getConstant() const;
158 
165  double getFarRadius() const;
166 
167  void toFile(const char * filename) const;
168  int n() const { return n_; }
169  double k() const { return k_; }
170 
171 private:
172  int n_; // principal quantum number of distorting state
173  double k_; // wavenumber of distorting state
174  double rmax_; // far radius
175 };
176 
177 #endif
const rArrays Ucoeffs
U polynomial coefficients.
Definition: potential.cpp:42
Distorting potential information.
Definition: potential.h:86
double plusMonopole(double x) const
Add multipole field potential to the distorting potential.
Definition: potential.cpp:96
DistortingPotential operator=(DistortingPotential const &V)
Assignment.
Definition: potential.cpp:58
DistortingPotential(DistortingPotential const &U)
Definition: potential.h:94
std::pair< double, int > getZeroAsymptotic(double x) const
Near-zero asymptotic behaviour.
Definition: potential.h:136
void toFile(const char *filename) const
Definition: potential.cpp:160
double getTurningPoint() const
Classical turning point.
Definition: potential.h:126
bool operator==(DistortingPotential const &V) const
Comparison.
Definition: potential.cpp:66
double k() const
Definition: potential.h:169
double getFarRadius() const
Return largest evaluated coordinate.
Definition: potential.cpp:124
int n() const
Definition: potential.h:168
DistortingPotential(int n, double rmax=0.)
Definition: potential.h:92
double getConstant() const
Return the zero limit.
Definition: potential.cpp:106
DistortingPotential(double k, double rmax=0.)
Definition: potential.h:93
DistortingPotential()
Definition: potential.h:91
double operator()(double x) const
Evaluate the distorting potential.
Definition: potential.cpp:72