Changes in src/sas/invariant/media/invariant_help.rst [0d66541:23a9beb] in sasview
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src/sas/invariant/media/invariant_help.rst
r0d66541 r23a9beb 1 .. invariant_help.rst1 .. invariant_help.rst 2 2 3 Placeholder for invariant help 3 .. This is a port of the original SasView html help file to ReSTructured text 4 .. by S King, ISIS, during SasView CodeCamp-III in Feb 2015. 5 6 Invariant Calculation Perspective 7 ================================= 8 9 Scattering_Invariant_ 10 11 Volume_Fraction_ 12 13 Specific_Surface_Area_ 14 15 Definitions_ 16 17 Reference_ 18 19 How_to_Use_ 20 21 .. ZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZ 22 23 .. _Scattering_Invariant: 24 25 Scattering Invariant 26 -------------------- 27 28 The scattering invariant (Q*) is a model-independent quantity that can be 29 easily calculated from scattering data. 30 31 For two phase systems, the scattering invariant, Q*, is defined as the 32 integral of the square of the wave transfer (q) multiplied by the scattering 33 cross section over the full range of q. 34 35 Q* is given by the following equation 36 37 .. image:: image001.gif 38 39 This model independent quantity (Q*) is calculated from the scattering data 40 that can be used to determine the volume fraction and the specific area of the 41 sample under consideration. 42 43 These quantities are useful in their own right and can be used in further 44 analysis. With this scattering invariant module users will also be able to 45 determine the consistency of those properties between data. There is no real 46 data defined from zero to infinity, there usually have limited range. 47 48 Q* is not really computed from zero to infinity. Our maximum q range is 49 1e-5 ~ 10 (1/Angstrom). The lower and/or higher q range than data given can be 50 extrapolated by fitting some data nearby. 51 52 The scattering invariant is computed as follows 53 54 *I(q)* = *I(q)* w/o background : If the data includes a background, user sets 55 the value to subtract the background for the Q* computation. 56 57 Reset *I(q)* = *I(q)* scaling factor* , delta *I(q) =* delta *I(q)*scaling 58 factor* : If non-zero scaling factor is given, it will be considered. 59 60 Invariant 61 62 .. image:: image001.gif 63 64 where *g =q* for the pinhole geometry and *g =qv* (the slit height) for the 65 slit geometry which can be given in data or as a value. 66 67 Higher q-region (\>= qmax in data) 68 69 Power law (w/o background term) function = C/q4will be used 70 71 where the constant C(=2pi(delta(rho))Sv) is to be found by fitting part of 72 data with the range of qN-mto qN(m\<N). 73 74 Lower q-region (\<= qmin in data): 75 76 Guinier function = *I0exp(-Rg2q2/3)* where I0and Rgare obtained by fitting, 77 78 similarly to the high q region above. 79 80 Power law can also be used. 81 82 .. ZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZ 83 84 .. _Volume_Fraction: 85 86 Volume Fraction 87 --------------- 88 89 .. image:: image002.gif 90 91 where delta(rho) is the SLD contrast of which value is given by users. 92 93 .. image:: image003.gif 94 95 Thus 96 97 where 0 =\< *A* =\<1/4 in order for these values to be physically valid. 98 99 .. ZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZ 100 101 .. _Specific_Surface_Area: 102 103 Specific Surface Area 104 --------------------- 105 106 .. image:: image004.gif 107 108 where *A* and *Q** are obtained from previous sections, and the Porod 109 constant *Cp* is given by users. 110 111 .. ZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZ 112 113 .. _Definitions: 114 115 Definitions 116 ----------- 117 118 Q: the magnitude of neutron (or X-ray) momentum transfer vector. 119 120 I(Q): the scattering intensity as a function of the momentum transfer Q. 121 122 Invariant total is the sum of the invariant calculated from datas q range and 123 the invariant resulting from extrapolation at low q range and at high q range 124 if considered. 125 126 .. ZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZ 127 128 .. _Reference: 129 130 References 131 ---------- 132 133 Chapter 2 in O. Glatter and O. Kratky, "Small Angle X-Ray Scattering", Academic 134 Press, New York, 1982 135 136 http://physchem.kfunigraz.ac.at/sm/ 137 138 .. ZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZZ 139 140 .. _How_to_Use: 141 142 How to Use 143 ---------- 144 145 1. Loading data to the panel: Open the data file from File in the menu bar. 146 Select loaded data from a plot panel by highlighting that it until its color 147 turns yellow. Then right click on that the data and selects the option Compute 148 Invariant. The application automatically computes the invariant value if the 149 data loaded is valid. 150 151 2. To subtract a background or/and to rescale the data, type the values in 152 Customized Input box. 153 154 3. If you want to calculate the volume fraction and the specific surface 155 area, type the optional inputs in the customized input box, and then press 156 'Compute' button. 157 158 4. The invariant can also be calculated including the outside of the data Q 159 range: To include the lower Q and/or the higher Q range, check in the enable 160 extrapolation check box in 'Extrapolation' box. If the power low is chosen, 161 the power (exponent) can be either held or fitted by checking the 162 corresponding radio button. The Npts that is being used for the extrapolation 163 can be specified. 164 165 5. If the invariant calculated from the extrapolated region is too large, it 166 will be warn in red at the top of the panel, which means that your data is not 167 proper to calculate the invariant. 168 169 6. The details of the calculation is available by clicking the 'Details' 170 button in the middle of the panel. 171 172 .. image:: image005.gif
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