[ViewVC] Diff of: OpenMD/branches/development/src/lattice/shapedLattice.cpp

Comparing branches/development/src/lattice/shapedLattice.cpp (file contents):
Revision 1465 by chuckv, Fri Jul 9 23:08:25 2010 UTC vs.
Revision 1701 by kstocke1, Thu Apr 5 19:37:58 2012 UTC

#	Line 35 \| Line 35
35		* [1] Meineke, et al., J. Comp. Chem. 26, 252-271 (2005).
36		* [2] Fennell & Gezelter, J. Chem. Phys. 124, 234104 (2006).
37		* [3] Sun, Lin & Gezelter, J. Chem. Phys. 128, 24107 (2008).
38	<	* [4] Vardeman & Gezelter, in progress (2009).
38	>	* [4] Kuang & Gezelter, J. Chem. Phys. 133, 164101 (2010).
39	>	* [4] Stocker & Gezelter, J. Chem. Theory Comput. 7, 834 (2011). *
40		*
40	–	*
41		* sphericalLattice.cpp
42		*
43		* Created by Charles F. Vardeman II on 17 Feb 2006.
44	+	* Edited by Kelsey M. Stocker on 23 Feb 2012.
45		* @author Charles F. Vardeman II
46		* @version $Id$
47		*
#	Line 80 \| Line 81 \| namespace OpenMD{
81		endNx_ = (int) ceil(0.5*dimension_[0]/latticeConstant_);
82		endNy_ = (int) ceil(0.5*dimension_[1]/latticeConstant_);
83		endNz_ = (int) ceil(0.5*dimension_[2]/latticeConstant_);
84	+	std::cerr << "begin = " << beginNx_ << " " << beginNy_ << " " << beginNz_ << "\n";
85	+	std::cerr << "end = " << endNx_ << " " << endNy_ << " " << endNz_ << "\n";
86		sitesComputed_ = false;
87		}
88

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