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root/OpenMD/branches/development/src/applications/nanoparticleBuilder/nanorodBuilder.cpp
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Comparing branches/development/src/applications/nanoparticleBuilder/nanorodBuilder.cpp (file contents):
Revision 1874 by gezelter, Wed May 15 15:09:35 2013 UTC vs.
Revision 1875 by gezelter, Fri May 17 14:41:42 2013 UTC

# Line 82 | Line 82 | int main(int argc, char *argv []) {
82    std::string latticeType;
83    std::string inputFileName;
84    std::string outputFileName;
85
85    MoLocator* locator;
86    int nComponents;
87    double latticeConstant;
89  std::vector<double> lc;
90
88    RealType rodRadius;
89    RealType rodLength;
93
90    Mat3x3d hmat;
95  std::vector<Vector3d> latticePos;
96  std::vector<Vector3d> latticeOrt;
97
91    DumpWriter *writer;
92    
93    // Parse Command Line Arguments
# Line 222 | Line 215 | int main(int argc, char *argv []) {
215    std::vector<Component*> components = simParams->getComponents();
216    std::vector<RealType> molFractions;
217    std::vector<RealType> shellRadii;
225  std::vector<RealType> molecularMasses;
218    std::vector<int> nMol;
219    std::map<int, int> componentFromSite;
220    nComponents = components.size();

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