occ::cg::ShapeFace Struct Reference

One active face of the particle shape, as the decomposition uses it: the support distance is per unit scale, and the optimal-cut offset and interplanar spacing are what snap it to a molecular termination. More...

#include <morphology_types.h>

Collaboration diagram for occ::cg::ShapeFace:

Public Attributes
occ::crystal::HKL	hkl
double	normal [3] {0.0, 0.0, 0.0}
	unit normal, Cartesian
double	distance {0.0}
	support distance at unit scale
double	offset {0.0}
	optimal cut offset, fraction of d
double	d_spacing {0.0}
	interplanar spacing (Angstrom)

Detailed Description

One active face of the particle shape, as the decomposition uses it: the support distance is per unit scale, and the optimal-cut offset and interplanar spacing are what snap it to a molecular termination.

Member Data Documentation

d_spacing

double occ::cg::ShapeFace::d_spacing {0.0}

interplanar spacing (Angstrom)

distance

double occ::cg::ShapeFace::distance {0.0}

support distance at unit scale

hkl

occ::crystal::HKL occ::cg::ShapeFace::hkl

normal

double occ::cg::ShapeFace::normal[3] {0.0, 0.0, 0.0}

unit normal, Cartesian

offset

double occ::cg::ShapeFace::offset {0.0}

optimal cut offset, fraction of d

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

• /home/runner/work/occ/occ/include/occ/cg/morphology_types.h