--- trunk/src/applications/staticProps/TwoDGofR.cpp 2012/08/22 02:28:28 1782 +++ trunk/src/applications/staticProps/TwoDGofR.cpp 2013/06/16 15:15:42 1879 @@ -35,7 +35,7 @@ * * [1] Meineke, et al., J. Comp. Chem. 26, 252-271 (2005). * [2] Fennell & Gezelter, J. Chem. Phys. 124, 234104 (2006). - * [3] Sun, Lin & Gezelter, J. Chem. Phys. 128, 24107 (2008). + * [3] Sun, Lin & Gezelter, J. Chem. Phys. 128, 234107 (2008). * [4] Kuang & Gezelter, J. Chem. Phys. 133, 164101 (2010). * [5] Vardeman, Stocker & Gezelter, J. Chem. Theory Comput. 7, 834 (2011). */ @@ -65,7 +65,7 @@ namespace OpenMD { std::fill(avgTwoDGofR_.begin(), avgTwoDGofR_.end(), 0.0); } - void TwoDGofR::initalizeHistogram() { + void TwoDGofR::initializeHistogram() { std::fill(histogram_.begin(), histogram_.end(), 0); } @@ -108,7 +108,7 @@ namespace OpenMD { RealType distance = sqrt(r12.x()*r12.x() + r12.y()*r12.y()); if (distance < len_) { - int whichBin = distance / deltaR_; + int whichBin = int(distance / deltaR_); histogram_[whichBin] += 2; } }