[ViewVC] Diff of: OpenMD/trunk/src/applications/staticProps/GofZ.cpp

Comparing trunk/src/applications/staticProps/GofZ.cpp (file contents):
Revision 1785 by jmichalk, Wed Aug 22 18:43:27 2012 UTC vs.
Revision 1879 by gezelter, Sun Jun 16 15:15:42 2013 UTC

#	Line 35 \| Line 35
35		*
36		* [1] Meineke, et al., J. Comp. Chem. 26, 252-271 (2005).
37		* [2] Fennell & Gezelter, J. Chem. Phys. 124, 234104 (2006).
38	<	* [3] Sun, Lin & Gezelter, J. Chem. Phys. 128, 24107 (2008).
38	>	* [3] Sun, Lin & Gezelter, J. Chem. Phys. 128, 234107 (2008).
39		* [4] Kuang & Gezelter, J. Chem. Phys. 133, 164101 (2010).
40		* [5] Vardeman, Stocker & Gezelter, J. Chem. Theory Comput. 7, 834 (2011).
41		*/
#	Line 90 \| Line 90 \| namespace OpenMD {
90
91		void GofZ::collectHistogram(StuntDouble* sd1, StuntDouble* sd2) {
92
93	–	RealType thisZ;
94	–
93		if (sd1 == sd2) {
94		return;
95		}
#	Line 107 \| Line 105 \| namespace OpenMD {
105		RealType xydist = sqrt(distance*distance - z2);
106
107		if (xydist < rC_) {
108	<	thisZ = abs(r12.z());
109	<	int whichBin = thisZ / deltaZ_;
108	>	RealType thisZ = abs(r12.z());
109	>	int whichBin = int(thisZ / deltaZ_);
110		histogram_[whichBin] += 2;
111		}
112		}

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