Crystal.h

Go to the documentation of this file.

// ************************************************************************** //
//
//  BornAgain: simulate and fit scattering at grazing incidence
//
//! @file      Sample/Particle/Crystal.h
//! @brief     Defines class Crystal.
//!
//! @homepage  http://www.bornagainproject.org
//! @license   GNU General Public License v3 or higher (see COPYING)
//! @copyright Forschungszentrum Jülich GmbH 2018
//! @authors   Scientific Computing Group at MLZ (see CITATION, AUTHORS)
//
// ************************************************************************** //
 
#ifndef BORNAGAIN_CORE_PARTICLE_CRYSTAL_H
#define BORNAGAIN_CORE_PARTICLE_CRYSTAL_H
 
#include "Sample/Lattice/Lattice.h"
#include "Sample/Particle/IClusteredParticles.h"
 
//! A crystal structure with a ParticleComposition as a basis.
//! Used in MesoCrystal, where it is given an outer shape.
//! @ingroup samples
 
class Crystal : public IClusteredParticles
{
public:
    Crystal(const IParticle& lattice_basis, const Lattice& lattice);
    ~Crystal();
 
    Crystal* clone() const override final;
 
    void accept(INodeVisitor* visitor) const override final { visitor->visit(this); }
 
    IFormFactor* createTotalFormFactor(const IFormFactor& meso_crystal_form_factor,
                                       const IRotation* p_rotation,
                                       const kvector_t& translation) const override final;
 
    std::vector<HomogeneousRegion> homogeneousRegions() const override final;
 
    Lattice transformedLattice(const IRotation* p_rotation = nullptr) const;
 
    void setPositionVariance(double position_variance) { m_position_variance = position_variance; }
 
    std::vector<const INode*> getChildren() const override final;
 
private:
    Crystal(IParticle* p_lattice_basis, const Lattice& lattice);
 
    Lattice m_lattice;
    std::unique_ptr<IParticle> mp_lattice_basis;
    double m_position_variance;
};
 
#endif // BORNAGAIN_CORE_PARTICLE_CRYSTAL_H