21 |
|
double sigma, s, eps; |
22 |
|
double rTerm, r6, r12; |
23 |
|
double energy; |
24 |
+ |
double range; |
25 |
|
|
26 |
|
char* shapeFileName; |
27 |
|
char* outputFileName; |
61 |
|
|
62 |
|
// grid has a default value (default=51), so it is always given |
63 |
|
npts = args_info.grid_arg; |
64 |
+ |
range = args_info.range_arg; |
65 |
|
|
66 |
< |
xmin = -10.0; |
67 |
< |
xmax = 10.0; |
66 |
> |
xmin = -range; |
67 |
> |
xmax = range; |
68 |
|
|
69 |
< |
ymin = -10.0; |
70 |
< |
ymax = 10.0; |
69 |
> |
ymin = -range; |
70 |
> |
ymax = range; |
71 |
|
|
72 |
< |
zmin = -10.0; |
73 |
< |
zmax = 10.0; |
72 |
> |
zmin = -range; |
73 |
> |
zmax = range; |
74 |
|
|
75 |
|
//sigmaProbe = 2.28; |
76 |
|
//sProbe = 2.28; |