OpenMD::Icosahedron Class Reference

Create the Mackay icosahedron structure. More...

#include <Icosahedron.hpp>

Public Member Functions
	Icosahedron ()
	Default constructor.
int	getNpoints (int nShells)
	Calculate number of particles in an icosahedron with nShells shells.
std::vector< Vector3d >	getPoints (int nShells)
	Get the generated points in an icosahedron with nShells shells.

Protected Member Functions
std::vector< Vector3d >	ih (int n)
	Create nth layer particles.
int	np (int n)
	Calculate number of particles on the nth layer.

Protected Attributes
std::vector< Vector3d >	Points
std::vector< std::pair< int, int > >	Edges
std::vector< std::tuple< int, int, int > >	Facets
std::vector< Vector3d >	Basis

Detailed Description

Create the Mackay icosahedron structure.

(Heavily modified from code from Yanting Wang date 07/21/2003)

Definition at line 65 of file Icosahedron.hpp.

Constructor & Destructor Documentation

Icosahedron()

OpenMD::Icosahedron::Icosahedron

(

)

Default constructor.

Definition at line 51 of file Icosahedron.cpp.

Member Function Documentation

getNpoints()

int OpenMD::Icosahedron::getNpoints

(

int

nShells

)

Calculate number of particles in an icosahedron with nShells shells.

Definition at line 149 of file Icosahedron.cpp.

References np().

getPoints()

std::vector< Vector3d > OpenMD::Icosahedron::getPoints

(

int

nShells

)

Get the generated points in an icosahedron with nShells shells.

Definition at line 231 of file Icosahedron.cpp.

References ih().

ih()

std::vector< Vector3d > OpenMD::Icosahedron::ih ( int n )

protected

Create nth layer particles.

Definition at line 175 of file Icosahedron.cpp.

Referenced by getPoints().

np()

int OpenMD::Icosahedron::np ( int n )

protected

Calculate number of particles on the nth layer.

Definition at line 156 of file Icosahedron.cpp.

Referenced by getNpoints().

Member Data Documentation

Basis

std::vector<Vector3d> OpenMD::Icosahedron::Basis

protected

Definition at line 86 of file Icosahedron.hpp.

Edges

std::vector<std::pair<int, int> > OpenMD::Icosahedron::Edges

protected

Definition at line 84 of file Icosahedron.hpp.

Facets

std::vector<std::tuple<int, int, int> > OpenMD::Icosahedron::Facets

protected

Definition at line 85 of file Icosahedron.hpp.

Points

std::vector<Vector3d> OpenMD::Icosahedron::Points

protected

Definition at line 83 of file Icosahedron.hpp.

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

• clusters/Icosahedron.hpp
• clusters/Icosahedron.cpp