occ::descriptors::Steinhardt Class Reference

#include <steinhardt.h>

Public Member Functions
	Steinhardt (size_t lmax)
Vec	compute_q (Eigen::Ref< const Mat3N > positions)
Vec	compute_w (Eigen::Ref< const Mat3N > positions)
CVec	compute_qlm (Eigen::Ref< const Mat3N > positions)
void	precompute_wigner3j_coefficients ()
size_t	size () const
size_t	nlm () const
Vec	compute_averaged_q (Eigen::Ref< const Mat3N > positions, double radius=6.0)
Vec	compute_averaged_w (Eigen::Ref< const Mat3N > positions, double radius=6.0)

Constructor & Destructor Documentation

Steinhardt()

occ::descriptors::Steinhardt::Steinhardt

(

size_t

lmax

)

Member Function Documentation

compute_averaged_q()

Vec occ::descriptors::Steinhardt::compute_averaged_q	(	Eigen::Ref< const Mat3N >	positions,
		double	radius = 6.0
	)

compute_averaged_w()

Vec occ::descriptors::Steinhardt::compute_averaged_w	(	Eigen::Ref< const Mat3N >	positions,
		double	radius = 6.0
	)

compute_q()

Vec occ::descriptors::Steinhardt::compute_q

(

Eigen::Ref< const Mat3N >

positions

)

compute_qlm()

CVec occ::descriptors::Steinhardt::compute_qlm

(

Eigen::Ref< const Mat3N >

positions

)

compute_w()

Vec occ::descriptors::Steinhardt::compute_w

(

Eigen::Ref< const Mat3N >

positions

)

nlm()

size_t occ::descriptors::Steinhardt::nlm ( ) const

inline

precompute_wigner3j_coefficients()

void occ::descriptors::Steinhardt::precompute_wigner3j_coefficients

(

)

size()

size_t occ::descriptors::Steinhardt::size ( ) const

inline

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

• /home/runner/work/occ/occ/include/occ/descriptors/steinhardt.h