1 // Voronoi calculation example code
3 // Author : Chris H. Rycroft (LBL / UC Berkeley)
4 // Email : chr@alum.mit.edu
5 // Date : August 30th 2011
10 // Set up constants for the container geometry
11 const double x_min
=-1,x_max
=1;
12 const double y_min
=-1,y_max
=1;
13 const double z_min
=-1,z_max
=1;
15 // Set up the number of blocks that the container is divided into
16 const int n_x
=6,n_y
=6,n_z
=6;
18 // Set the number of particles that are going to be randomly introduced
19 const int particles
=20;
21 // This function returns a random double between 0 and 1
22 double rnd() {return double(rand())/RAND_MAX
;}
28 // Create a container with the geometry given above, and make it
29 // non-periodic in each of the three coordinates. Allocate space for
30 // eight particles within each computational block
31 container
con(x_min
,x_max
,y_min
,y_max
,z_min
,z_max
,n_x
,n_y
,n_z
,
34 // Randomly add particles into the container
35 for(i
=0;i
<particles
;i
++) {
36 x
=x_min
+rnd()*(x_max
-x_min
);
37 y
=y_min
+rnd()*(y_max
-y_min
);
38 z
=z_min
+rnd()*(z_max
-z_min
);
42 double vo
[400],ar
[400],tvo
,tar
;
43 for(i
=0;i
<400;i
++) vo
[i
]=0;
44 for(i
=0;i
<400;i
++) ar
[i
]=0;
48 if(cl
.start()) do if(con
.compute_cell(c
,cl
)) {
50 c
.minkowski(i
*0.005,tvo
,tar
);
51 vo
[i
]+=tvo
;ar
[i
]+=tar
;
56 for(i
=0;i
<400;i
++) printf("%g %g %g\n",i
*0.005,vo
[i
],ar
[i
]);