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@ -2977,7 +2977,7 @@ double PairAIREBO::PijSpline(double NijC, double NijH, int typei, int typej,
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double PairAIREBO::piRCSpline(double Nij, double Nji, double Nijconj,
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int typei, int typej, double dN3[3])
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{
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int x,y,z,i,j,k,l,trigger,done;
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int x,y,z,i,j,k,l,done;
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double piRC,coeffs[64];
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x=0;
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y=0;
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@ -2985,10 +2985,9 @@ double PairAIREBO::piRCSpline(double Nij, double Nji, double Nijconj,
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i=0;
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j=0;
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done=0;
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trigger=0;
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for (i=0; i<64; i++) {
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coeffs[i]=0.0;
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}
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for (i=0; i<64; i++) coeffs[i]=0.0;
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if (typei==0 && typej==0) {
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//if the inputs are out of bounds set them back to a point in bounds
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if (Nij<piCCdom[0][0]) Nij=piCCdom[0][0];
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@ -3100,14 +3099,12 @@ double PairAIREBO::TijSpline(double Nij, double Nji,
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{
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int x,y,z,i,done;
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double Tijf,coeffs[64];
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int trigger;
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x=0;
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y=0;
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z=0;
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i=0;
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Tijf=0.0;
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trigger=0;
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done=0;
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for (i=0; i<64; i++) coeffs[i]=0.0;
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