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Last change
on this file since 5eb9154 was
5eb9154,
checked in by Jae Cho <jhjcho@…>, 15 years ago
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calculation of the effective radius are added
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-
Property mode set to
100644
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File size:
1.0 KB
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[25579e8] | 1 | /** |
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[5eb9154] | 2 | * SquareWell Structure factor |
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[25579e8] | 3 | * @author: Jae Hie Cho / UTK |
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| 4 | */ |
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| 5 | |
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| 6 | #include "HayterMSA.h" |
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| 7 | #include "libStructureFactor.h" |
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| 8 | #include <math.h> |
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| 9 | |
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| 10 | |
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| 11 | /** |
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| 12 | * Function to evaluate 1D scattering function |
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| 13 | * @param pars: parameters of the HayterPenfoldMSA |
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| 14 | * @param q: q-value |
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| 15 | * @return: function value |
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| 16 | */ |
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| 17 | double HayterMSA_analytical_1D(HayterMSAParameters *pars, double q) { |
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| 18 | double dp[6]; |
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| 19 | |
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[5eb9154] | 20 | dp[0] = pars->effect_radius; |
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[25579e8] | 21 | dp[1] = pars->charge; |
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| 22 | dp[1] = pars->volfraction; |
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| 23 | dp[3] = pars->temperature; |
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| 24 | dp[4] = pars->saltconc; |
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| 25 | dp[5] = pars->dielectconst; |
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[5eb9154] | 26 | |
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[25579e8] | 27 | return HayterPenfoldMSA(dp, q); |
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| 28 | } |
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[5eb9154] | 29 | |
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[25579e8] | 30 | /** |
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| 31 | * Function to evaluate 2D scattering function |
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| 32 | * @param pars: parameters of the HayterPenfoldMSA |
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| 33 | * @param q: q-value |
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| 34 | * @return: function value |
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| 35 | */ |
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| 36 | double HayterMSA_analytical_2D(HayterMSAParameters *pars, double q, double phi) { |
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| 37 | return HayterMSA_analytical_1D(pars,q); |
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| 38 | } |
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| 39 | |
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| 40 | double HayterMSA_analytical_2DXY(HayterMSAParameters *pars, double qx, double qy){ |
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[5eb9154] | 41 | return HayterMSA_analytical_1D(pars,sqrt(qx*qx+qy*qy)); |
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[25579e8] | 42 | } |
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