Inheritance diagram for ExactSpinor:
Collaboration diagram for ExactSpinor:
Public Member Functions | |
| ExactSpinor (const int n, const char lc, const double j, const int Z, const double m=0.0) | |
| ExactSpinor (const int n, const int l, const double j, const int Z, const double m=0.0) | |
| double_complex | angular (const coord_3d &c, const double g, const double f) const |
| double | compute_C () const |
| double | compute_en () const |
| double | compute_energy () const |
| std::string | filename () const |
| double_complex | Fvalue (const coord_3d &coord) const |
| double | get_energy () const |
| Spinor | get_spinor (World &world) const |
| std::string | l_to_string (const long l) const |
| double_complex | operator() (const coord_3d &c) const override |
| void | print () const |
| double_complex | psivalue (const coord_3d &coord) const |
| void | set_ansatz (const AnsatzBase &ansatz) |
| Level | special_level () override |
| Override this change level refinement for special points (default is 6) More... | |
| std::vector< Vector< double, 3UL > > | special_points () const override |
| Override this to return list of special points to be refined more deeply. More... | |
 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) More... | |
| virtual bool | provides_coeff () const |
| does this functor directly provide sum coefficients? or only function values? More... | |
| 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? More... | |
| void | set_length_scale (double lo) |
| adapt the special level to resolve the smallest length scale More... | |
| virtual bool | supports_vectorized () const |
| Does the interface support a vectorized operator()? More... | |
| virtual coeffT | values (const keyT &key, const Tensor< double > &tensor) const |
Static Public Member Functions | |
| static int | l_char_to_int (const char lc) |
Public Attributes | |
| double | C =0.0 |
| int | component =0 |
| bool | compute_F =false |
| double | cusp_a =-1.0 |
| double | E =0.0 |
| double | gamma =0.0 |
| double | j |
| long | k |
| long | l |
| double | m |
| long | n |
| bool | regularized =true |
| double | Z |
| Public Attributes inherited from madness::FunctionFunctorInterface< double_complex, 3 > | |
| Level | special_level_ |
Additional Inherited Members | |
| 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
◆ ExactSpinor() [1/2]
|
inline |
◆ ExactSpinor() [2/2]
|
inline |
References std::abs(), alpha1, compute_energy(), k, m, and Z.
Member Function Documentation
◆ angular()
|
inline |
References c, madness::f, madness::g, m, MADNESS_EXCEPTION, and pow().
◆ compute_C()
|
inline |
References alpha1, c, and MADNESS_CHECK.
◆ compute_en()
◆ compute_energy()
|
inline |
References std::abs(), alpha1, c, k, MADNESS_CHECK, pow(), and Z.
◆ filename()
|
inline |
Referenced by eigenvector_test().
◆ Fvalue()
|
inline |
References std::abs(), alpha1, c, compute_gamma(), generalized_laguerre(), k, m, MADNESS_EXCEPTION, madness::Vector< T, N >::normf(), pow(), and Z.
◆ get_energy()
|
inline |
Referenced by eigenvector_test(), main(), and run().
◆ get_spinor()
References Spinor::components.
Referenced by eigenvector_test().
◆ l_char_to_int()
|
inlinestatic |
References MADNESS_EXCEPTION.
◆ l_to_string()
|
inline |
◆ operator()()
|
inlineoverride |
References c.
◆ print()
|
inline |
References alpha1, k, m, MADNESS_CHECK, and madness::print().
Referenced by eigenvector_test().
◆ psivalue()
|
inline |
References std::abs(), alpha1, c, compute_gamma(), madness::f, madness::g, generalized_laguerre(), k, m, MADNESS_EXCEPTION, madness::Vector< T, N >::normf(), pow(), and Z.
◆ set_ansatz()
|
inline |
References AnsatzBase::get_cusp_a(), and AnsatzBase::iansatz.
Referenced by eigenvector_test().
◆ special_level()
|
inlineoverridevirtual |
Override this change level refinement for special points (default is 6)
Reimplemented from madness::FunctionFunctorInterface< double_complex, 3 >.
◆ special_points()
|
inlineoverridevirtual |
Override this to return list of special points to be refined more deeply.
Reimplemented from madness::FunctionFunctorInterface< double_complex, 3 >.
Member Data Documentation
◆ C
| double ExactSpinor::C =0.0 |
◆ component
|
mutable |
◆ compute_F
| bool ExactSpinor::compute_F =false |
Referenced by run().
◆ cusp_a
| double ExactSpinor::cusp_a =-1.0 |
Referenced by run().
◆ E
| double ExactSpinor::E =0.0 |
◆ gamma
| double ExactSpinor::gamma =0.0 |
◆ j
| double ExactSpinor::j |
◆ k
| long ExactSpinor::k |
◆ l
| long ExactSpinor::l |
◆ m
| double ExactSpinor::m |
◆ n
| long ExactSpinor::n |
◆ regularized
| bool ExactSpinor::regularized =true |
◆ Z
| double ExactSpinor::Z |
The documentation for this struct was generated from the following file:
