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root/OpenMD/branches/development/src/lattice/shapedLattice.cpp

Comparing:
trunk/src/lattice/shapedLattice.cpp (file contents), Revision 1390 by gezelter, Wed Nov 25 20:02:06 2009 UTC vs.
branches/development/src/lattice/shapedLattice.cpp (file contents), 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: shapedLattice.cpp,v 1.8 2009-11-25 20:02:01 gezelter Exp $
46	>	*  @version $Id$
47		*
48		*/
49
#	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

Comparing:
trunk/src/lattice/shapedLattice.cpp (property svn:keywords), Revision 1390 by gezelter, Wed Nov 25 20:02:06 2009 UTC vs.
branches/development/src/lattice/shapedLattice.cpp (property svn:keywords), Revision 1701 by kstocke1, Thu Apr 5 19:37:58 2012 UTC

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