#include <global.h>

Data Fields
int	species

int	totcoord [10]

int *	ntg [10]

int **	geolist [10]

int ***	partial_geo

int	cmin

int	cmax

Detailed Description

Definition at line 126 of file global.h.

Field Documentation

◆ cmax

int cmax

The Maximum coordination number

Definition at line 146 of file global.h.

◆ cmin

int cmin

The minimum coordination number

Definition at line 145 of file global.h.

◆ geolist

int** geolist[10]

The corresponding list of geometries

Definition at line 143 of file global.h.

◆ ntg

int* ntg[10]

The number of objects by chemical species

Definition at line 142 of file global.h.

◆ partial_geo

int*** partial_geo

The list of partial geometries

Definition at line 144 of file global.h.

◆ species

int species

The number of chemical species

Definition at line 128 of file global.h.

◆ totcoord

int totcoord[10]

The total number of objects:
0 = total coordination(s),
1 = partial coordination(s),
2 = fragment(s),
3 = molecule(s),
4 to 8 = ring statistics,
9 = chain statistics

Definition at line 135 of file global.h.

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

global.h

Data Fields