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root/OpenMD/branches/development/src/brains/Thermo.cpp
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Comparing trunk/src/brains/Thermo.cpp (file contents):
Revision 833 by tim, Fri Dec 30 21:25:56 2005 UTC vs.
Revision 945 by gezelter, Tue Apr 25 02:09:01 2006 UTC

# Line 70 | Line 70 | namespace oopse {
70      for (mol = info_->beginMolecule(miter); mol != NULL; mol = info_->nextMolecule(miter)) {
71        for (integrableObject = mol->beginIntegrableObject(iiter); integrableObject != NULL;
72             integrableObject = mol->nextIntegrableObject(iiter)) {
73 <
73 >        
74          double mass = integrableObject->getMass();
75          Vector3d vel = integrableObject->getVel();
76 <
76 >        
77          kinetic += mass * (vel[0]*vel[0] + vel[1]*vel[1] + vel[2]*vel[2]);
78 <
78 >        
79          if (integrableObject->isDirectional()) {
80            angMom = integrableObject->getJ();
81            I = integrableObject->getI();

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