Inheritance diagram for votca::csg::OrthorhombicBox:

Collaboration diagram for votca::csg::OrthorhombicBox:

Public Member Functions
Eigen::Vector3d	BCShortestConnection (const Eigen::Vector3d &r_i, const Eigen::Vector3d &r_j) const final

virtual std::unique_ptr< BoundaryCondition >	Clone () const final
	Safe way to allow child classes to be copied.

eBoxtype	getBoxType () const noexcept final

Public Member Functions inherited from votca::csg::BoundaryCondition
virtual	~BoundaryCondition ()=default

void	setBox (const Eigen::Matrix3d &box) noexcept

const Eigen::Matrix3d &	getBox () const noexcept

double	getShortestBoxDimension () const
	Self explanatory gets the shortest dimension of the boundary conditions.

virtual double	BoxVolume () const noexcept

Additional Inherited Members
Public Types inherited from votca::csg::BoundaryCondition
enum	eBoxtype { typeAuto = 0 , typeTriclinic , typeOrthorhombic , typeOpen }

Protected Attributes inherited from votca::csg::BoundaryCondition
Eigen::Matrix3d	box_

Detailed Description

Definition at line 27 of file orthorhombicbox.h.

Member Function Documentation

Eigen::Vector3d votca::csg::OrthorhombicBox::BCShortestConnection	(	const Eigen::Vector3d &	r_i,
		const Eigen::Vector3d &	r_j ) const

finalvirtual

get shortest connection vector between r_i and r_j with respect to the (periodic) box

Definition at line 24 of file orthorhombicbox.cc.

virtual std::unique_ptr< BoundaryCondition > votca::csg::OrthorhombicBox::Clone ( ) const

inlinefinalvirtual

Safe way to allow child classes to be copied.

The child classes must use the same method and override it with their type for this to work.

Definition at line 33 of file orthorhombicbox.h.

eBoxtype votca::csg::OrthorhombicBox::getBoxType ( ) const

inlinefinalvirtualnoexcept

Definition at line 37 of file orthorhombicbox.h.

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