voronoi_qlm.hpp File Reference

Voronoi facet-area weighted bond order parameters. More...

#include <bop.hpp>
#include <mol_sys.hpp>
#include <vector>

Go to the source code of this file.

Classes
struct	chill::VoronoiWeights
	The Voronoi facet neighbours of one particle and their area weights. More...

Namespaces
namespace	chill
	CHILL and CHILL+ structure classification.

Functions
std::vector< VoronoiWeights >	chill::voronoiFacetWeights (const molSys::PointCloud< molSys::Point< double >, double > &yCloud, double candidateCutoff)
	Facet neighbours and area weights for every particle, with an a posteriori exactness certificate.
SteinhardtQl	chill::steinhardtQlVoronoi (const molSys::PointCloud< molSys::Point< double >, double > &yCloud, double candidateCutoff, int orderL)

Detailed Description

Voronoi facet-area weighted bond order parameters.

Definition in file voronoi_qlm.hpp.