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* Created by J. Daniel Gezelter on 09/26/06. |
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* @author J. Daniel Gezelter |
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* @version $Id: BondOrderParameter.cpp,v 1.18 2006-09-26 16:08:44 gezelter Exp $ |
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* @version $Id: BondOrderParameter.cpp,v 1.19 2006-10-18 21:58:47 gezelter Exp $ |
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* |
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*/ |
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if (atom->getGlobalIndex() != myIndex) { |
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vec = sd->getPos() - atom->getPos(); |
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currentSnapshot_->wrapVector(vec); |
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if (usePeriodicBoundaryConditions_) |
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currentSnapshot_->wrapVector(vec); |
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// Calculate "bonds" and build Q_lm(r) where |
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// Q_lm = Y_lm(theta(r),phi(r)) |