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root/OpenMD/trunk/src/visitors/RigidBodyVisitor.cpp

Comparing trunk/src/visitors/RigidBodyVisitor.cpp (file contents):
Revision 1390 by gezelter, Wed Nov 25 20:02:06 2009 UTC vs.
Revision 2071 by gezelter, Sat Mar 7 21:41:51 2015 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).
39	<	* [4]  Vardeman & Gezelter, in progress (2009).
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		*/
42
43		#include "visitors/RigidBodyVisitor.hpp"
#	Line 88 | Line 89 | namespace OpenMD {
89		atomInfo->pos[0] = pos[0];
90		atomInfo->pos[1] = pos[1];
91		atomInfo->pos[2] = pos[2];
92	<	atomInfo->dipole[0] = newVec[0];
93	<	atomInfo->dipole[1] = newVec[1];
94	<	atomInfo->dipole[2] = newVec[2];
92	>	atomInfo->vec[0] = newVec[0];
93	>	atomInfo->vec[1] = newVec[1];
94	>	atomInfo->vec[2] = newVec[2];
95
96		atomData->addAtomInfo(atomInfo);
97
#	Line 147 | Line 148 | namespace OpenMD {
148		void RBCOMVisitor::visit(RigidBody* rb){
149		AtomData* atomData;
150		AtomInfo* atomInfo;
151	<	Vector3d pos;
151	>	Vector3d pos = rb->getPos();
152
152	–	pos = rb->getPos();
153		atomInfo = new AtomInfo;
154		atomInfo->atomTypeName = "X";
155		atomInfo->pos[0] = pos[0];
156		atomInfo->pos[1] = pos[1];
157		atomInfo->pos[2] = pos[2];
158	<	atomInfo->dipole[0] = 0;
159	<	atomInfo->dipole[1] = 0;
160	<	atomInfo->dipole[2] = 0;
158	>	atomInfo->vec[0] = 0;
159	>	atomInfo->vec[1] = 0;
160	>	atomInfo->vec[2] = 0;
161
162		atomData = new AtomData;
163		atomData->setID("ATOMDATA");

Comparing trunk/src/visitors/RigidBodyVisitor.cpp (property svn:keywords):
Revision 1390 by gezelter, Wed Nov 25 20:02:06 2009 UTC vs.
Revision 2071 by gezelter, Sat Mar 7 21:41:51 2015 UTC

#	Line 0 | Line 1
1	+	Author Id Revision Date

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