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root/OpenMD/branches/development/src/applications/staticProps/RhoR.cpp
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Comparing branches/development/src/applications/staticProps/RhoR.cpp (file contents):
Revision 1764 by gezelter, Tue Jul 3 18:32:27 2012 UTC vs.
Revision 1794 by gezelter, Thu Sep 6 19:44:06 2012 UTC

# Line 103 | Line 103 | namespace OpenMD {
103          RealType distance = r12.length();
104          
105          if (distance < len_) {
106 <          int whichBin = distance / deltaR_;
106 >          int whichBin = int(distance / deltaR_);
107            histogram_[whichBin] += 1;
108          }
109          
# Line 122 | Line 122 | namespace OpenMD {
122      RealType particleDensity =  3.0 * info_->getNGlobalMolecules() / (4.0 * NumericConstant::PI * pow(particleR_,3));
123      RealType pairConstant = ( 4.0 * NumericConstant::PI * particleDensity ) / 3.0;
124  
125 <    for(int i = 0 ; i < histogram_.size(); ++i){
125 >    for(unsigned int i = 0 ; i < histogram_.size(); ++i){
126  
127        RealType rLower = i * deltaR_;
128        RealType rUpper = rLower + deltaR_;
# Line 141 | Line 141 | namespace OpenMD {
141      if (rdfStream.is_open()) {
142        rdfStream << "#radial density function rho(r)\n";
143        rdfStream << "#r\tcorrValue\n";
144 <      for (int i = 0; i < avgRhoR_.size(); ++i) {
144 >      for (unsigned int i = 0; i < avgRhoR_.size(); ++i) {
145          RealType r = deltaR_ * (i + 0.5);
146          rdfStream << r << "\t" << avgRhoR_[i]/nProcessed_ << "\n";
147        }

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