[27a0771] | 1 | /** |
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| 2 | This software was developed by the University of Tennessee as part of the |
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| 3 | Distributed Data Analysis of Neutron Scattering Experiments (DANSE) |
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| 4 | project funded by the US National Science Foundation. |
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| 5 | |
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| 6 | If you use DANSE applications to do scientific research that leads to |
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| 7 | publication, we ask that you acknowledge the use of the software with the |
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| 8 | following sentence: |
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| 9 | |
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| 10 | "This work benefited from DANSE software developed under NSF award DMR-0520547." |
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| 11 | |
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| 12 | copyright 2008, University of Tennessee |
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| 13 | */ |
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| 14 | |
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| 15 | /** |
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| 16 | * Scattering model classes |
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| 17 | * The classes use the IGOR library found in |
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| 18 | * sansmodels/src/libigor |
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| 19 | * |
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| 20 | * TODO: refactor so that we pull in the old sansmodels.c_extensions |
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| 21 | * TODO: add 2D function |
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| 22 | */ |
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| 23 | |
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| 24 | #include <math.h> |
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| 25 | #include "models.hh" |
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| 26 | #include "parameters.hh" |
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| 27 | #include <stdio.h> |
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| 28 | using namespace std; |
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| 29 | |
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| 30 | extern "C" { |
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| 31 | #include "libCylinder.h" |
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| 32 | #include "lamellarPS.h" |
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| 33 | } |
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| 34 | |
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| 35 | LamellarPSModel :: LamellarPSModel() { |
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| 36 | scale = Parameter(1.0); |
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[b4679de] | 37 | spacing = Parameter(400.0, true); |
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| 38 | spacing.set_min(0.0); |
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| 39 | delta = Parameter(30.0); |
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[27a0771] | 40 | delta.set_min(0.0); |
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| 41 | contrast = Parameter(5.3e-6); |
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| 42 | n_plates = Parameter(20.0); |
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| 43 | caille = Parameter(0.1); |
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| 44 | background = Parameter(0.0); |
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| 45 | |
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| 46 | } |
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| 47 | |
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| 48 | /** |
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| 49 | * Function to evaluate 1D scattering function |
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| 50 | * The NIST IGOR library is used for the actual calculation. |
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| 51 | * @param q: q-value |
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| 52 | * @return: function value |
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| 53 | */ |
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| 54 | double LamellarPSModel :: operator()(double q) { |
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[c1c29b6] | 55 | double dp[7]; |
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[27a0771] | 56 | |
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| 57 | // Fill parameter array for IGOR library |
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| 58 | // Add the background after averaging |
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| 59 | dp[0] = scale(); |
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| 60 | dp[1] = spacing(); |
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| 61 | dp[2] = delta(); |
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[c1c29b6] | 62 | dp[3] = contrast(); |
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| 63 | dp[4] = n_plates(); |
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| 64 | dp[5] = caille(); |
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| 65 | dp[6] = 0.0; |
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[b4679de] | 66 | |
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[27a0771] | 67 | |
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[c1c29b6] | 68 | // Get the dispersion points for spacing and delta (thickness) |
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[b4679de] | 69 | vector<WeightPoint> weights_spacing; |
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| 70 | spacing.get_weights(weights_spacing); |
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[c1c29b6] | 71 | vector<WeightPoint> weights_delta; |
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| 72 | delta.get_weights(weights_delta); |
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[b4679de] | 73 | |
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[27a0771] | 74 | // Perform the computation, with all weight points |
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| 75 | double sum = 0.0; |
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| 76 | double norm = 0.0; |
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[b4679de] | 77 | |
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[27a0771] | 78 | // Loop over short_edgeA weight points |
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[b4679de] | 79 | for(int i=0; i< (int)weights_spacing.size(); i++) { |
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| 80 | dp[1] = weights_spacing[i].value; |
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[c1c29b6] | 81 | for(int j=0; j< (int)weights_spacing.size(); j++) { |
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| 82 | dp[2] = weights_delta[i].value; |
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[b4679de] | 83 | |
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[c1c29b6] | 84 | sum += weights_spacing[i].weight * weights_delta[j].weight * LamellarPS_kernel(dp, q); |
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| 85 | norm += weights_spacing[i].weight * weights_delta[j].weight; |
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| 86 | } |
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[27a0771] | 87 | } |
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| 88 | return sum/norm + background(); |
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| 89 | } |
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| 90 | /** |
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| 91 | * Function to evaluate 2D scattering function |
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| 92 | * @param q_x: value of Q along x |
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| 93 | * @param q_y: value of Q along y |
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| 94 | * @return: function value |
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| 95 | */ |
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| 96 | double LamellarPSModel :: operator()(double qx, double qy) { |
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[b4679de] | 97 | double q = sqrt(qx*qx + qy*qy); |
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| 98 | return (*this).operator()(q); |
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[27a0771] | 99 | } |
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| 100 | |
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| 101 | /** |
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| 102 | * Function to evaluate 2D scattering function |
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| 103 | * @param pars: parameters of the cylinder |
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| 104 | * @param q: q-value |
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| 105 | * @param phi: angle phi |
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| 106 | * @return: function value |
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| 107 | */ |
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| 108 | double LamellarPSModel :: evaluate_rphi(double q, double phi) { |
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[b4679de] | 109 | return (*this).operator()(q); |
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[27a0771] | 110 | } |
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[5eb9154] | 111 | /** |
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| 112 | * Function to calculate effective radius |
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| 113 | * @return: effective radius value |
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| 114 | */ |
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| 115 | double LamellarPSModel :: calculate_ER() { |
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| 116 | //NOT implemented yet!!! |
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| 117 | } |
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[c1c29b6] | 118 | |
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