#include <init.hpp>

Inheritance diagram for q3::QuantumStateInterpolator:

Public Member Functions
virtual	~QuantumStateInterpolator ()=default

virtual std::string	description () const =0
	One line for logs: the method and the size of the model.

virtual std::map< std::string, Real >	diagnostics () const

virtual std::vector< Real >	eigenvalues_at (const Vector3D &kpoint) const =0
	Ascending eigenvalues in Rydberg at one k-point in crystal coordinates.

virtual int	number_of_bands () const =0
	Number of eigenvalues returned per k-point.

Detailed Description

Definition at line 38 of file init.hpp.

Constructor & Destructor Documentation

◆ ~QuantumStateInterpolator()

virtual q3::QuantumStateInterpolator::~QuantumStateInterpolator ( )

virtualdefault

Member Function Documentation

◆ description()

virtual std::string q3::QuantumStateInterpolator::description ( ) const

pure virtual

One line for logs: the method and the size of the model.

Implemented in q3::LocalOrbitalQuantumStateInterpolator.

Referenced by q3::InterpolationResultsDocument::describe_model().

◆ diagnostics()

virtual std::map< std::string, Real > q3::QuantumStateInterpolator::diagnostics ( ) const

inlinevirtual

Method-specific numbers worth reporting beside the results – a model's size, a weight identity it checked – keyed by a name fit for a JSON report. Empty by default; a method with nothing to add adds nothing.

Reimplemented in q3::LocalOrbitalQuantumStateInterpolator.

Definition at line 57 of file init.hpp.

Referenced by q3::InterpolationResultsDocument::describe_model().