[ViewVC] Diff of: OpenMD/branches/development/src/applications/nanoparticleBuilder/nanoparticleBuilder.cpp

Comparing branches/development/src/applications/nanoparticleBuilder/nanoparticleBuilder.cpp (file contents):
Revision 1465 by chuckv, Fri Jul 9 23:08:25 2010 UTC vs.
Revision 1704 by gezelter, Tue Apr 24 20:40:04 2012 UTC

#	Line 36 \| Line 36
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).
39	<	* [4] Vardeman & Gezelter, in progress (2009).
39	>	* [4] Kuang & Gezelter, J. Chem. Phys. 133, 164101 (2010).
40	>	* [5] Vardeman, Stocker & Gezelter, J. Chem. Theory Comput. 7, 834 (2011).
41		*/
42
43		#include <cstdlib>
#	Line 126 \| Line 127 \| *int main(int argc, char argv []) {**
127		/* Build a lattice and get lattice points for this lattice constant */
128		vector<Vector3d> sites = nanoParticle.getSites();
129		vector<Vector3d> orientations = nanoParticle.getOrientations();
130	+
131	+
132		std::vector<int> vacancyTargets;
133		vector<bool> isVacancy;
134

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