81 |
|
#include "applications/staticProps/RNEMDStats.hpp" |
82 |
|
#include "applications/staticProps/NitrileFrequencyMap.hpp" |
83 |
|
#include "applications/staticProps/MultipoleSum.hpp" |
84 |
+ |
#include "applications/staticProps/SurfaceDiffusion.hpp" |
85 |
|
|
86 |
|
using namespace OpenMD; |
87 |
|
|
415 |
|
analyser = new Hxy(info, dumpFileName, sele1, args_info.nbins_x_arg, |
416 |
|
args_info.nbins_y_arg, args_info.nbins_arg); |
417 |
|
#endif |
418 |
+ |
}else if (args_info.surfDiffusion_given){ |
419 |
+ |
analyser = new SurfaceDiffusion(info, dumpFileName, sele1, maxLen); |
420 |
|
}else if (args_info.rho_r_given) { |
421 |
|
if (args_info.radius_given){ |
422 |
|
analyser = new RhoR(info, dumpFileName, sele1, maxLen,args_info.nbins_arg,args_info.radius_arg); |