1 | """ |
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2 | This object is a small tool to allow user to quickly |
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3 | determine the variance in q from the |
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4 | instrumental parameters. |
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5 | """ |
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6 | from instrument import Sample |
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7 | from instrument import Detector |
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8 | from instrument import Neutron |
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9 | from instrument import Aperture |
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10 | # import math stuffs |
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11 | from math import pi |
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12 | from math import sqrt |
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13 | from math import cos |
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14 | from math import sin |
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15 | from math import atan |
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16 | from math import atan2 |
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17 | from math import pow |
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18 | from math import asin |
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19 | from math import tan |
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20 | |
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21 | import numpy |
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22 | |
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23 | #Plank's constant in cgs unit |
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24 | _PLANK_H = 6.62606896E-27 |
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25 | #Gravitational acc. in cgs unit |
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26 | _GRAVITY = 981.0 |
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27 | |
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28 | class ResolutionCalculator(object): |
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29 | """ |
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30 | compute resolution in 2D |
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31 | """ |
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32 | def __init__(self): |
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33 | |
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34 | # wavelength |
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35 | self.wave = Neutron() |
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36 | # sample |
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37 | self.sample = Sample() |
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38 | # aperture |
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39 | self.aperture = Aperture() |
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40 | # detector |
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41 | self.detector = Detector() |
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42 | # 2d image of the resolution |
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43 | self.image = [] |
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44 | # resolutions |
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45 | self.sigma_1 = 0 |
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46 | self.sigma_2 = 0 |
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47 | self.sigma_1d = 0 |
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48 | # q min and max |
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49 | self.qx_min = -0.3 |
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50 | self.qx_max = 0.3 |
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51 | self.qy_min = -0.3 |
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52 | self.qy_max = 0.3 |
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53 | # q min and max of the detector |
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54 | self.detector_qx_min = -0.3 |
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55 | self.detector_qx_max = 0.3 |
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56 | self.detector_qy_min = -0.3 |
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57 | self.detector_qy_max = 0.3 |
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58 | # plots |
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59 | self.plot = None |
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60 | # instrumental params defaults |
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61 | self.mass = 0 |
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62 | self.intensity = 0 |
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63 | self.wavelength = 0 |
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64 | self.wavelength_spread = 0 |
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65 | self.source_aperture_size = [] |
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66 | self.source2sample_distance = [] |
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67 | self.sample2sample_distance = [] |
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68 | self.sample_aperture_size = [] |
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69 | self.sample2detector_distance = [] |
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70 | self.detector_pix_size = [] |
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71 | self.detector_size = [] |
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72 | # get all the values of the instrumental parameters |
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73 | self.get_all_instrument_params() |
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74 | |
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75 | def compute_and_plot(self, qx_value, qy_value, qx_min, qx_max, |
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76 | qy_min, qy_max, coord = 'polar'): |
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77 | """ |
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78 | Compute the resolution |
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79 | : qx_value: x component of q |
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80 | : qy_value: y component of q |
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81 | """ |
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82 | # compute 2d resolution |
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83 | _, _, sigma_1, sigma_2 = self.compute(qx_value, qy_value, coord) |
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84 | # make image |
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85 | image = self.get_image(qx_value, qy_value, sigma_1, sigma_2, |
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86 | qx_min, qx_max, qy_min, qy_max, coord) |
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87 | # plot image |
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88 | return self.plot_image(image) |
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89 | |
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90 | def compute(self, qx_value, qy_value, coord = 'polar'): |
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91 | """ |
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92 | Compute the Q resoltuion in || and + direction of 2D |
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93 | : qx_value: x component of q |
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94 | : qy_value: y component of q |
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95 | """ |
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96 | # make sure to update all the variables need. |
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97 | self.get_all_instrument_params() |
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98 | # wavelength |
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99 | lamb = self.wavelength |
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100 | |
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101 | if lamb == 0: |
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102 | msg = "Can't compute the resolution: the wavelength is zero..." |
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103 | raise RuntimeError, msg |
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104 | # wavelength spread |
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105 | lamb_spread = self.wavelength_spread |
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106 | # Find polar values |
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107 | qr_value, phi = self._get_polar_value(qx_value, qy_value) |
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108 | # vacuum wave transfer |
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109 | knot = 2*pi/lamb |
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110 | # scattering angle theta; always true for plane detector |
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111 | # aligned vertically to the ko direction |
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112 | if qr_value > knot: |
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113 | theta = pi/2 |
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114 | else: |
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115 | theta = asin(qr_value/knot) |
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116 | # source aperture size |
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117 | rone = self.source_aperture_size |
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118 | # sample aperture size |
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119 | rtwo = self.sample_aperture_size |
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120 | # detector pixel size |
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121 | rthree = self.detector_pix_size |
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122 | # source to sample(aperture) distance |
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123 | l_ssa = self.source2sample_distance[0] |
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124 | # sample(aperture) to detector distance |
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125 | l_sad = self.sample2detector_distance[0] |
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126 | # sample (aperture) to sample distance |
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127 | l_sas = self.sample2sample_distance[0] |
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128 | # source to sample distance |
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129 | l_one = l_ssa + l_sas |
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130 | # sample to detector distance |
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131 | l_two = l_sad - l_sas |
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132 | |
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133 | # Sample offset correction for l_one and Lp on variance calculation |
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134 | l1_cor = (l_ssa * l_two) / (l_sas + l_two) |
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135 | lp_cor = (l_ssa * l_two) / (l_one + l_two) |
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136 | # the radial distance to the pixel from the center of the detector |
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137 | radius = tan(theta)*l_two |
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138 | #Lp = l_one*l_two/(l_one+l_two) |
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139 | # default polar coordinate |
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140 | comp1 = 'radial' |
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141 | comp2 = 'phi' |
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142 | # in the case of the cartesian coordinate |
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143 | if coord == 'cartesian': |
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144 | comp1 = 'x' |
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145 | comp2 = 'y' |
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146 | |
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147 | # sigma in the radial/x direction |
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148 | # for source aperture |
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149 | sigma_1 = self.get_variance(rone, l1_cor, phi, comp1) |
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150 | # for sample apperture |
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151 | sigma_1 += self.get_variance(rtwo, lp_cor, phi, comp1) |
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152 | # for detector pix |
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153 | sigma_1 += self.get_variance(rthree, l_two, phi, comp1) |
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154 | # for gravity term |
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155 | sigma_1 += self.get_variance_gravity(l_ssa, l_sad, lamb, lamb_spread, |
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156 | phi, comp1, 'on') |
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157 | # for wavelength spread |
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158 | # reserve for 1d calculation |
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159 | sigma_wave_1 = self.get_variance_wave(radius, l_two, lamb_spread, |
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160 | phi, comp1, 'on') |
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161 | # for 1d |
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162 | variance_1d_1 = sigma_1/2 +sigma_wave_1 |
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163 | # normalize |
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164 | variance_1d_1 = knot*knot*variance_1d_1/12 |
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165 | |
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166 | # for 2d |
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167 | sigma_1 += sigma_wave_1 |
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168 | # normalize |
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169 | sigma_1 = knot*sqrt(sigma_1/12) |
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170 | |
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171 | # sigma in the phi/y direction |
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172 | # for source apperture |
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173 | sigma_2 = self.get_variance(rone, l1_cor, phi, comp2) |
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174 | # for sample apperture |
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175 | sigma_2 += self.get_variance(rtwo, lp_cor, phi, comp2) |
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176 | # for detector pix |
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177 | sigma_2 += self.get_variance(rthree, l_two, phi, comp2) |
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178 | # for gravity term |
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179 | sigma_2 += self.get_variance_gravity(l_ssa, l_sad, lamb, lamb_spread, |
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180 | phi, comp2, 'on') |
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181 | # for wavelength spread |
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182 | # reserve for 1d calculation |
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183 | sigma_wave_2 = self.get_variance_wave(radius, l_two, lamb_spread, |
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184 | phi, comp2, 'on') |
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185 | # for 1d |
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186 | variance_1d_2 = sigma_2/2 +sigma_wave_2 |
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187 | # normalize |
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188 | variance_1d_2 = knot*knot*variance_1d_2/12 |
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189 | |
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190 | # for 2d |
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191 | sigma_2 += sigma_wave_2 |
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192 | # normalize |
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193 | sigma_2 = knot*sqrt(sigma_2/12) |
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194 | |
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195 | # set sigmas |
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196 | self.sigma_1 = sigma_1 |
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197 | self.sigma_2 = sigma_2 |
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198 | |
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199 | self.sigma_1d = sqrt(variance_1d_1 + variance_1d_2) |
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200 | return qr_value, phi, sigma_1, sigma_2 |
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201 | |
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202 | def get_image(self, qx_value, qy_value, sigma_1, sigma_2, |
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203 | qx_min, qx_max, qy_min, qy_max, coord = 'polar'): |
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204 | """ |
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205 | Get the resolution in polar coordinate ready to plot |
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206 | : qx_value: qx_value value |
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207 | : qy_value: qy_value value |
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208 | : sigma_1: variance in r direction |
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209 | : sigma_2: variance in phi direction |
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210 | : coord: coordinate system of image, 'polar' or 'cartesian' |
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211 | """ |
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212 | # Get qx_max and qy_max... |
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213 | output = self._get_detector_qxqy_pixels() |
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214 | # Set qx_value/qy_value min/max |
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215 | #qx_min = self.qx_min |
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216 | #qx_max = self.qx_max |
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217 | #qy_min = self.qy_min |
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218 | #qy_max = self.qy_max |
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219 | |
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220 | # Find polar values |
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221 | qr_value, phi = self._get_polar_value(qx_value, qy_value) |
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222 | |
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223 | # Check whether the q value is within the detector range |
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224 | msg = "Invalid input: Q value out of the detector range..." |
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225 | if qx_min < self.qx_min: |
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226 | self.qx_min = qx_min |
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227 | #raise ValueError, msg |
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228 | if qx_max > self.qx_max: |
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229 | self.qx_max = qx_max |
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230 | #raise ValueError, msg |
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231 | if qy_min < self.qy_min: |
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232 | self.qy_min = qy_min |
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233 | #raise ValueError, msg |
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234 | if qy_max > self.qy_max: |
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235 | self.qy_max = qy_max |
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236 | #raise ValueError, msg |
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237 | |
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238 | # Make an empty graph in the detector scale |
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239 | dx_size = (self.qx_max - self.qx_min) / (1000 - 1) |
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240 | dy_size = (self.qy_max - self.qy_min) / (1000 - 1) |
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241 | x_val = numpy.arange(self.qx_min, self.qx_max, dx_size) |
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242 | y_val = numpy.arange(self.qy_max, self.qy_min, -dy_size) |
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243 | q_1, q_2 = numpy.meshgrid(x_val, y_val) |
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244 | |
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245 | # check whether polar or cartesian |
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246 | if coord == 'polar': |
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247 | q_1, q_2 = self._rotate_z(q_1, q_2, phi) |
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248 | qc_1 = qr_value |
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249 | qc_2 = 0.0 |
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250 | else: |
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251 | # catesian coordinate |
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252 | # qx_center |
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253 | qc_1 = qx_value |
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254 | # qy_center |
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255 | qc_2 = qy_value |
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256 | |
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257 | # Calculate the 2D Gaussian distribution image |
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258 | image = self._gaussian2d(q_1, q_2, qc_1, qc_2, sigma_1, sigma_2) |
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259 | # Add it if there are more than one inputs. |
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260 | if len(self.image) > 0: |
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261 | self.image += image |
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262 | else: |
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263 | self.image = image |
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264 | |
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265 | return self.image |
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266 | |
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267 | def plot_image(self, image): |
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268 | """ |
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269 | Plot image using pyplot |
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270 | : image: 2d resolution image |
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271 | |
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272 | : return plt: pylab object |
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273 | """ |
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274 | import matplotlib.pyplot as plt |
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275 | |
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276 | self.plot = plt |
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277 | plt.xlabel('$\\rm{Q}_{x} [A^{-1}]$') |
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278 | plt.ylabel('$\\rm{Q}_{y} [A^{-1}]$') |
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279 | # Max value of the image |
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280 | max = numpy.max(image) |
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281 | # Image |
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282 | im = plt.imshow(image, |
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283 | extent = [self.qx_min, self.qx_max, self.qy_min, self.qy_max]) |
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284 | |
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285 | # bilinear interpolation to make it smoother |
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286 | im.set_interpolation('bilinear') |
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287 | |
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288 | return plt |
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289 | |
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290 | def reset_image(self): |
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291 | """ |
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292 | Reset image to default (=[]) |
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293 | """ |
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294 | self.image = [] |
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295 | |
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296 | def get_variance(self, size = [], distance = 0, phi = 0, comp = 'radial'): |
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297 | """ |
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298 | Get the variance when the slit/pinhole size is given |
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299 | : size: list that can be one(diameter for circular) |
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300 | or two components(lengths for rectangular) |
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301 | : distance: [z, x] where z along the incident beam, x // qx_value |
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302 | : comp: direction of the sigma; can be 'phi', 'y', 'x', and 'radial' |
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303 | |
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304 | : return variance: sigma^2 |
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305 | """ |
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306 | # check the length of size (list) |
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307 | len_size = len(size) |
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308 | |
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309 | # define sigma component direction |
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310 | if comp == 'radial': |
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311 | phi_x = cos(phi) |
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312 | phi_y = sin(phi) |
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313 | elif comp == 'phi': |
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314 | phi_x = sin(phi) |
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315 | phi_y = cos(phi) |
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316 | elif comp == 'x': |
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317 | phi_x = 1 |
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318 | phi_y = 0 |
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319 | elif comp == 'y': |
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320 | phi_x = 0 |
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321 | phi_y = 1 |
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322 | else: |
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323 | phi_x = 0 |
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324 | phi_y = 0 |
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325 | # calculate each component |
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326 | # for pinhole w/ radius = size[0]/2 |
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327 | if len_size == 1: |
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328 | x_comp = (0.5 * size[0]) * sqrt(3) |
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329 | y_comp = 0 |
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330 | # for rectangular slit |
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331 | elif len_size == 2: |
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332 | x_comp = size[0] * phi_x |
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333 | y_comp = size[1] * phi_y |
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334 | # otherwise |
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335 | else: |
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336 | raise ValueError, " Improper input..." |
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337 | # get them squared |
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338 | sigma = x_comp * x_comp |
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339 | sigma += y_comp * y_comp |
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340 | # normalize by distance |
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341 | sigma /= (distance * distance) |
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342 | |
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343 | return sigma |
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344 | |
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345 | def get_variance_wave(self, radius, distance, spread, phi, |
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346 | comp = 'radial', switch = 'on'): |
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347 | """ |
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348 | Get the variance when the wavelength spread is given |
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349 | |
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350 | : radius: the radial distance from the beam center to the pix of q |
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351 | : distance: sample to detector distance |
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352 | : spread: wavelength spread (ratio) |
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353 | : comp: direction of the sigma; can be 'phi', 'y', 'x', and 'radial' |
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354 | |
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355 | : return variance: sigma^2 |
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356 | """ |
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357 | if switch.lower() == 'off': |
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358 | return 0 |
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359 | # check the singular point |
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360 | if distance == 0 or comp == 'phi': |
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361 | return 0 |
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362 | else: |
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363 | # calculate sigma^2 |
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364 | sigma = 2 * pow(radius/distance*spread, 2) |
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365 | if comp == 'x': |
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366 | sigma *= (cos(phi)*cos(phi)) |
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367 | elif comp == 'y': |
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368 | sigma *= (sin(phi)*sin(phi)) |
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369 | else: |
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370 | sigma *= 1 |
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371 | |
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372 | return sigma |
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373 | |
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374 | def get_variance_gravity(self, s_distance, d_distance, wavelength, spread, |
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375 | phi, comp = 'radial', switch = 'on'): |
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376 | """ |
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377 | Get the variance from gravity when the wavelength spread is given |
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378 | |
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379 | : s_distance: source to sample distance |
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380 | : d_distance: sample to detector distance |
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381 | : wavelength: wavelength |
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382 | : spread: wavelength spread (ratio) |
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383 | : comp: direction of the sigma; can be 'phi', 'y', 'x', and 'radial' |
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384 | |
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385 | : return variance: sigma^2 |
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386 | """ |
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387 | if switch.lower() == 'off': |
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388 | return 0 |
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389 | if self.mass == 0.0: |
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390 | return 0 |
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391 | # check the singular point |
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392 | if d_distance == 0 or comp == 'x': |
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393 | return 0 |
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394 | else: |
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395 | # neutron mass in cgs unit |
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396 | self.mass = self.get_neutron_mass() |
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397 | # plank constant in cgs unit |
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398 | h_constant = _PLANK_H |
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399 | # gravity in cgs unit |
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400 | gravy = _GRAVITY |
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401 | # m/h |
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402 | m_over_h = self.mass /h_constant |
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403 | # A value |
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404 | a_value = d_distance * (s_distance + d_distance) |
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405 | a_value *= pow(m_over_h / 2, 2) |
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406 | a_value *= gravy |
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407 | # unit correction (1/cm to 1/A) for A and d_distance below |
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408 | a_value *= 1.0E-16 |
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409 | |
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410 | # calculate sigma^2 |
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411 | sigma = pow(a_value / d_distance, 2) |
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412 | sigma *= pow(wavelength, 4) |
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413 | sigma *= pow(spread, 2) |
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414 | sigma *= 8 |
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415 | |
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416 | # only for the polar coordinate |
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417 | if comp == 'radial': |
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418 | sigma *= (sin(phi) * sin(phi)) |
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419 | elif comp == 'phi': |
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420 | sigma *= (cos(phi) * cos(phi)) |
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421 | |
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422 | return sigma |
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423 | |
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424 | def get_intensity(self): |
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425 | """ |
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426 | Get intensity |
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427 | """ |
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428 | return self.wave.intensity |
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429 | |
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430 | def get_wavelength(self): |
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431 | """ |
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432 | Get wavelength |
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433 | """ |
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434 | return self.wave.wavelength |
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435 | |
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436 | def get_wavelength_spread(self): |
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437 | """ |
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438 | Get wavelength spread |
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439 | """ |
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440 | return self.wave.wavelength_spread |
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441 | |
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442 | def get_neutron_mass(self): |
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443 | """ |
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444 | Get Neutron mass |
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445 | """ |
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446 | return self.wave.mass |
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447 | |
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448 | def get_source_aperture_size(self): |
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449 | """ |
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450 | Get source aperture size |
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451 | """ |
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452 | return self.aperture.source_size |
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453 | |
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454 | def get_sample_aperture_size(self): |
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455 | """ |
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456 | Get sample aperture size |
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457 | """ |
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458 | return self.aperture.sample_size |
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459 | |
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460 | def get_detector_pix_size(self): |
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461 | """ |
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462 | Get detector pixel size |
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463 | """ |
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464 | return self.detector.pix_size |
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465 | |
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466 | def get_detector_size(self): |
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467 | """ |
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468 | Get detector size |
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469 | """ |
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470 | return self.detector.size |
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471 | |
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472 | def get_source2sample_distance(self): |
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473 | """ |
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474 | Get detector source2sample_distance |
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475 | """ |
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476 | return self.aperture.sample_distance |
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477 | |
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478 | def get_sample2sample_distance(self): |
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479 | """ |
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480 | Get detector sampleslitsample_distance |
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481 | """ |
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482 | return self.sample.distance |
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483 | |
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484 | def get_sample2detector_distance(self): |
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485 | """ |
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486 | Get detector sample2detector_distance |
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487 | """ |
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488 | return self.detector.distance |
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489 | |
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490 | def set_intensity(self, intensity): |
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491 | """ |
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492 | Set intensity |
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493 | """ |
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494 | self.wave.set_intensity(intensity) |
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495 | |
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496 | def set_wavelength(self, wavelength): |
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497 | """ |
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498 | Set wavelength |
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499 | """ |
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500 | self.wave.set_wavelength(wavelength) |
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501 | |
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502 | def set_wavelength_spread(self, wavelength_spread): |
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503 | """ |
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504 | Set wavelength spread |
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505 | """ |
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506 | self.wave.set_wavelength_spread(wavelength_spread) |
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507 | |
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508 | def set_source_aperture_size(self, size): |
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509 | """ |
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510 | Set source aperture size |
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511 | |
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512 | : param size: [dia_value] or [x_value, y_value] |
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513 | """ |
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514 | if len(size) < 1 or len(size) > 2: |
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515 | raise RuntimeError, "The length of the size must be one or two." |
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516 | self.aperture.set_source_size(size) |
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517 | |
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518 | def set_neutron_mass(self, mass): |
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519 | """ |
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520 | Set Neutron mass |
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521 | """ |
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522 | self.wave.set_mass(mass) |
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523 | |
---|
524 | def set_sample_aperture_size(self, size): |
---|
525 | """ |
---|
526 | Set sample aperture size |
---|
527 | |
---|
528 | : param size: [dia_value] or [xheight_value, yheight_value] |
---|
529 | """ |
---|
530 | if len(size) < 1 or len(size) > 2: |
---|
531 | raise RuntimeError, "The length of the size must be one or two." |
---|
532 | self.aperture.set_sample_size(size) |
---|
533 | |
---|
534 | def set_detector_pix_size(self, size): |
---|
535 | """ |
---|
536 | Set detector pixel size |
---|
537 | """ |
---|
538 | self.detector.set_pix_size(size) |
---|
539 | |
---|
540 | def set_detector_size(self, size): |
---|
541 | """ |
---|
542 | Set detector size in number of pixels |
---|
543 | : param size: [pixel_nums] or [x_pix_num, yx_pix_num] |
---|
544 | """ |
---|
545 | self.detector.set_size(size) |
---|
546 | |
---|
547 | def set_source2sample_distance(self, distance): |
---|
548 | """ |
---|
549 | Set detector source2sample_distance |
---|
550 | |
---|
551 | : param distance: [distance, x_offset] |
---|
552 | """ |
---|
553 | if len(distance) < 1 or len(distance) > 2: |
---|
554 | raise RuntimeError, "The length of the size must be one or two." |
---|
555 | self.aperture.set_sample_distance(distance) |
---|
556 | |
---|
557 | def set_sample2sample_distance(self, distance): |
---|
558 | """ |
---|
559 | Set detector sample_slit2sample_distance |
---|
560 | |
---|
561 | : param distance: [distance, x_offset] |
---|
562 | """ |
---|
563 | if len(distance) < 1 or len(distance) > 2: |
---|
564 | raise RuntimeError, "The length of the size must be one or two." |
---|
565 | self.sample.set_distance(distance) |
---|
566 | |
---|
567 | def set_sample2detector_distance(self, distance): |
---|
568 | """ |
---|
569 | Set detector sample2detector_distance |
---|
570 | |
---|
571 | : param distance: [distance, x_offset] |
---|
572 | """ |
---|
573 | if len(distance) < 1 or len(distance) > 2: |
---|
574 | raise RuntimeError, "The length of the size must be one or two." |
---|
575 | self.detector.set_distance(distance) |
---|
576 | |
---|
577 | def get_all_instrument_params(self): |
---|
578 | """ |
---|
579 | Get all instrumental parameters |
---|
580 | """ |
---|
581 | self.intensity = self.get_intensity() |
---|
582 | self.wavelength = self.get_wavelength() |
---|
583 | self.wavelength_spread = self.get_wavelength_spread() |
---|
584 | self.mass = self.get_neutron_mass() |
---|
585 | self.source_aperture_size = self.get_source_aperture_size() |
---|
586 | self.sample_aperture_size = self.get_sample_aperture_size() |
---|
587 | self.detector_pix_size = self.get_detector_pix_size() |
---|
588 | self.detector_size = self.get_detector_size() |
---|
589 | self.source2sample_distance = self.get_source2sample_distance() |
---|
590 | self.sample2sample_distance = self.get_sample2sample_distance() |
---|
591 | self.sample2detector_distance = self.get_sample2detector_distance() |
---|
592 | |
---|
593 | |
---|
594 | |
---|
595 | def _rotate_z(self, x_value, y_value, theta= 0.0): |
---|
596 | """ |
---|
597 | Rotate x-y cordinate around z-axis by theta |
---|
598 | : x_value: numpy array of x values |
---|
599 | : y_value: numpy array of y values |
---|
600 | : theta: angle to rotate by in rad |
---|
601 | |
---|
602 | :return: x_prime, y-prime |
---|
603 | """ |
---|
604 | # rotate by theta |
---|
605 | x_prime = x_value * cos(theta) + y_value * sin(theta) |
---|
606 | y_prime = -x_value * sin(theta) + y_value * cos(theta) |
---|
607 | |
---|
608 | return x_prime, y_prime |
---|
609 | |
---|
610 | def _gaussian2d(self, x_val, y_val, x0_val, y0_val, sigma_x, sigma_y): |
---|
611 | """ |
---|
612 | Calculate 2D Gaussian distribution |
---|
613 | : x_val: x value |
---|
614 | : y_val: y value |
---|
615 | : x0_val: mean value in x-axis |
---|
616 | : y0_val: mean value in y-axis |
---|
617 | : sigma_x: variance in x-direction |
---|
618 | : sigma_y: variance in y-direction |
---|
619 | |
---|
620 | : return: gaussian (value) |
---|
621 | """ |
---|
622 | # call gaussian1d |
---|
623 | gaussian = self._gaussian1d(x_val, x0_val, sigma_x) |
---|
624 | gaussian *= self._gaussian1d(y_val, y0_val, sigma_y) |
---|
625 | |
---|
626 | # normalizing factor correction |
---|
627 | if sigma_x != 0 and sigma_y != 0: |
---|
628 | gaussian *= sqrt(2 * pi) |
---|
629 | return gaussian |
---|
630 | |
---|
631 | def _gaussian1d(self, value, mean, sigma): |
---|
632 | """ |
---|
633 | Calculate 1D Gaussian distribution |
---|
634 | : value: value |
---|
635 | : mean: mean value |
---|
636 | : sigma: variance |
---|
637 | |
---|
638 | : return: gaussian (value) |
---|
639 | """ |
---|
640 | # default |
---|
641 | gaussian = 1.0 |
---|
642 | if sigma != 0: |
---|
643 | # get exponent |
---|
644 | nu_value = (value - mean) / sigma |
---|
645 | nu_value *= nu_value |
---|
646 | nu_value *= -0.5 |
---|
647 | gaussian *= numpy.exp(nu_value) |
---|
648 | gaussian /= sigma |
---|
649 | # normalize |
---|
650 | gaussian /= sqrt(2 * pi) |
---|
651 | |
---|
652 | return gaussian |
---|
653 | |
---|
654 | def _atan_phi(self, qy_value, qx_value): |
---|
655 | """ |
---|
656 | Find the angle phi of q on the detector plane for qx_value, qy_value given |
---|
657 | : qx_value: x component of q |
---|
658 | : qy_value: y component of q |
---|
659 | |
---|
660 | : return phi: the azimuthal angle of q on x-y plane |
---|
661 | """ |
---|
662 | # default |
---|
663 | phi = 0 |
---|
664 | # ToDo: This is misterious - sign??? |
---|
665 | #qy_value = -qy_value |
---|
666 | # Take care of the singular point |
---|
667 | if qx_value == 0: |
---|
668 | if qy_value > 0: |
---|
669 | phi = pi / 2 |
---|
670 | elif qy_value < 0: |
---|
671 | phi = -pi / 2 |
---|
672 | else: |
---|
673 | phi = 0 |
---|
674 | else: |
---|
675 | # the angle |
---|
676 | phi = atan2(qy_value, qx_value) |
---|
677 | |
---|
678 | return phi |
---|
679 | |
---|
680 | def _get_detector_qxqy_pixels(self): |
---|
681 | """ |
---|
682 | Get the pixel positions of the detector in the qx_value-qy_value space |
---|
683 | """ |
---|
684 | |
---|
685 | # update all param values |
---|
686 | self.get_all_instrument_params() |
---|
687 | |
---|
688 | # wavelength |
---|
689 | wavelength = self.wavelength |
---|
690 | # Gavity correction |
---|
691 | delta_y = self._get_beamcenter_drop() # in cm |
---|
692 | |
---|
693 | # detector_pix size |
---|
694 | detector_pix_size = self.detector_pix_size |
---|
695 | # Square or circular pixel |
---|
696 | if len(detector_pix_size) == 1: |
---|
697 | pix_x_size = detector_pix_size[0] |
---|
698 | pix_y_size = detector_pix_size[0] |
---|
699 | # rectangular pixel pixel |
---|
700 | elif len(detector_pix_size) == 2: |
---|
701 | pix_x_size = detector_pix_size[0] |
---|
702 | pix_y_size = detector_pix_size[1] |
---|
703 | else: |
---|
704 | raise ValueError, " Input value format error..." |
---|
705 | # Sample to detector distance = sample slit to detector |
---|
706 | # minus sample offset |
---|
707 | sample2detector_distance = self.sample2detector_distance[0] - \ |
---|
708 | self.sample2sample_distance[0] |
---|
709 | # detector offset in x-direction |
---|
710 | detector_offset = 0 |
---|
711 | try: |
---|
712 | detector_offset = self.sample2detector_distance[1] |
---|
713 | except: |
---|
714 | pass |
---|
715 | |
---|
716 | # detector size in [no of pix_x,no of pix_y] |
---|
717 | detector_pix_nums_x = self.detector_size[0] |
---|
718 | |
---|
719 | # get pix_y if it exists, otherwse take it from [0] |
---|
720 | try: |
---|
721 | detector_pix_nums_y = self.detector_size[1] |
---|
722 | except: |
---|
723 | detector_pix_nums_y = self.detector_size[0] |
---|
724 | |
---|
725 | # detector offset in pix number |
---|
726 | offset_x = detector_offset / pix_x_size |
---|
727 | offset_y = delta_y / pix_y_size |
---|
728 | |
---|
729 | # beam center position in pix number (start from 0) |
---|
730 | center_x, center_y = self._get_beamcenter_position(detector_pix_nums_x, |
---|
731 | detector_pix_nums_y, offset_x, offset_y) |
---|
732 | # distance [cm] from the beam center on detector plane |
---|
733 | detector_ind_x = numpy.arange(detector_pix_nums_x) |
---|
734 | detector_ind_y = numpy.arange(detector_pix_nums_y) |
---|
735 | |
---|
736 | # shif 0.5 pixel so that pix position is at the center of the pixel |
---|
737 | detector_ind_x = detector_ind_x + 0.5 |
---|
738 | detector_ind_y = detector_ind_y + 0.5 |
---|
739 | |
---|
740 | # the relative postion from the beam center |
---|
741 | detector_ind_x = detector_ind_x - center_x |
---|
742 | detector_ind_y = detector_ind_y - center_y |
---|
743 | |
---|
744 | # unit correction in cm |
---|
745 | detector_ind_x = detector_ind_x * pix_x_size |
---|
746 | detector_ind_y = detector_ind_y * pix_y_size |
---|
747 | |
---|
748 | qx_value = numpy.zeros(len(detector_ind_x)) |
---|
749 | qy_value = numpy.zeros(len(detector_ind_y)) |
---|
750 | i = 0 |
---|
751 | |
---|
752 | for indx in detector_ind_x: |
---|
753 | qx_value[i] = self._get_qx(indx, sample2detector_distance, wavelength) |
---|
754 | i += 1 |
---|
755 | i = 0 |
---|
756 | for indy in detector_ind_y: |
---|
757 | qy_value[i] = self._get_qx(indy, sample2detector_distance, wavelength) |
---|
758 | i += 1 |
---|
759 | |
---|
760 | # qx_value and qy_value values in array |
---|
761 | qx_value = qx_value.repeat(detector_pix_nums_y) |
---|
762 | qx_value = qx_value.reshape(detector_pix_nums_x, detector_pix_nums_y) |
---|
763 | qy_value = qy_value.repeat(detector_pix_nums_x) |
---|
764 | qy_value = qy_value.reshape(detector_pix_nums_y, detector_pix_nums_x) |
---|
765 | qy_value = qy_value.transpose() |
---|
766 | |
---|
767 | # p min and max values among the center of pixels |
---|
768 | self.qx_min = numpy.min(qx_value) |
---|
769 | self.qx_max = numpy.max(qx_value) |
---|
770 | self.qy_min = numpy.min(qy_value) |
---|
771 | self.qy_max = numpy.max(qy_value) |
---|
772 | |
---|
773 | # Appr. min and max values of the detector display limits |
---|
774 | # i.e., edges of the last pixels. |
---|
775 | self.qy_min += self._get_qx(-0.5 * pix_y_size, |
---|
776 | sample2detector_distance, wavelength) |
---|
777 | self.qy_max += self._get_qx(0.5 * pix_y_size, |
---|
778 | sample2detector_distance, wavelength) |
---|
779 | #if self.qx_min == self.qx_max: |
---|
780 | self.qx_min += self._get_qx(-0.5 * pix_x_size, |
---|
781 | sample2detector_distance, wavelength) |
---|
782 | self.qx_max += self._get_qx(0.5 * pix_x_size, |
---|
783 | sample2detector_distance, wavelength) |
---|
784 | # min and max values of detecter |
---|
785 | self.detector_qx_min = self.qx_min |
---|
786 | self.detector_qx_max = self.qx_max |
---|
787 | self.detector_qy_min = self.qy_min |
---|
788 | self.detector_qy_max = self.qy_max |
---|
789 | |
---|
790 | # try to set it as a Data2D otherwise pass (not required for now) |
---|
791 | try: |
---|
792 | from DataLoader.data_info import Data2D |
---|
793 | output = Data2D() |
---|
794 | inten = numpy.zeros_like(qx_value) |
---|
795 | output.data = inten |
---|
796 | output.qx_data = qx_value |
---|
797 | output.qy_data = qy_value |
---|
798 | except: |
---|
799 | pass |
---|
800 | |
---|
801 | return output#qx_value,qy_value |
---|
802 | |
---|
803 | def _get_qx(self, dx_size, det_dist, wavelength): |
---|
804 | """ |
---|
805 | :param dx_size: x-distance from beam center [cm] |
---|
806 | :param det_dist: sample to detector distance [cm] |
---|
807 | |
---|
808 | :return: q-value at the given position |
---|
809 | """ |
---|
810 | # Distance from beam center in the plane of detector |
---|
811 | plane_dist = dx_size |
---|
812 | # full scattering angle on the x-axis |
---|
813 | theta = atan(plane_dist / det_dist) |
---|
814 | qx_value = (2.0 * pi / wavelength) * sin(theta) |
---|
815 | return qx_value |
---|
816 | |
---|
817 | def _get_polar_value(self, qx_value, qy_value): |
---|
818 | """ |
---|
819 | Find qr_value and phi from qx_value and qy_value values |
---|
820 | |
---|
821 | : return qr_value, phi |
---|
822 | """ |
---|
823 | # find |q| on detector plane |
---|
824 | qr_value = sqrt(qx_value*qx_value + qy_value*qy_value) |
---|
825 | # find angle phi |
---|
826 | phi = self._atan_phi(qy_value, qx_value) |
---|
827 | |
---|
828 | return qr_value, phi |
---|
829 | |
---|
830 | def _get_beamcenter_position(self, num_x, num_y, offset_x, offset_y): |
---|
831 | """ |
---|
832 | :param num_x: number of pixel in x-direction |
---|
833 | :param num_y: number of pixel in y-direction |
---|
834 | :param offset: detector offset in x-direction in pix number |
---|
835 | |
---|
836 | :return: pix number; pos_x, pos_y in pix index |
---|
837 | """ |
---|
838 | # beam center position |
---|
839 | pos_x = num_x / 2 |
---|
840 | pos_y = num_y / 2 |
---|
841 | |
---|
842 | # correction for offset |
---|
843 | pos_x += offset_x |
---|
844 | # correction for gravity that is always negative |
---|
845 | pos_y -= offset_y |
---|
846 | |
---|
847 | return pos_x, pos_y |
---|
848 | |
---|
849 | def _get_beamcenter_drop(self): |
---|
850 | """ |
---|
851 | Get the beam center drop (delta y) in y diection due to gravity |
---|
852 | |
---|
853 | :return delta y: the beam center drop in cm |
---|
854 | """ |
---|
855 | # Check if mass == 0 (X-ray). |
---|
856 | if self.mass == 0: |
---|
857 | return 0 |
---|
858 | # Covert unit from A to cm |
---|
859 | unit_cm = 1e-08 |
---|
860 | # Velocity of neutron in horizontal direction (~ actual velocity) |
---|
861 | velocity = _PLANK_H / (self.mass * self.wavelength * unit_cm) |
---|
862 | # Compute delta y |
---|
863 | delta_y = 0.5 |
---|
864 | delta_y *= _GRAVITY |
---|
865 | delta_y *= self.sample2detector_distance[0] |
---|
866 | delta_y *= (self.source2sample_distance[0] + self.sample2detector_distance[0]) |
---|
867 | delta_y /= (velocity * velocity) |
---|
868 | |
---|
869 | return delta_y |
---|
870 | |
---|
871 | |
---|