[503a972] | 1 | #if !defined(lamellarPC_h) |
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| 2 | #define lamellarPC_h |
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| 3 | #include "parameters.hh" |
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| 4 | |
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| 5 | /** Structure definition for lamellar_paracrystal parameters |
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| 6 | * [PYTHONCLASS] = LamellarPCrystalModel |
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| 7 | * [DISP_PARAMS] = thickness |
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| 8 | [DESCRIPTION] = <text>[Lamellar ParaCrystal Model] Parameter Definitions: scale = scale factor, |
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| 9 | background = incoherent background |
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| 10 | thickness = lamellar thickness, |
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| 11 | sld_layer = layer scattering length density , |
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| 12 | sld_solvent = solvent scattering length density. |
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| 13 | Nlayers = no. of lamellar layers |
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| 14 | spacing = spacing between layers |
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| 15 | pd_spacing = polydispersity of spacing |
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| 16 | Note: This model can be used for large |
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| 17 | multilamellar vesicles. |
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| 18 | |
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| 19 | </text> |
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| 20 | [FIXED]= thickness.width; |
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| 21 | [ORIENTATION_PARAMS]= |
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| 22 | **/ |
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| 23 | |
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| 24 | class LamellarPCrystalModel{ |
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| 25 | public: |
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| 26 | // Model parameters |
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| 27 | /// Scale factor |
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| 28 | // [DEFAULT]=scale=1.0 |
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| 29 | Parameter scale; |
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| 30 | /// thickness |
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| 31 | // [DEFAULT]=thickness=33.0 [A] |
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| 32 | Parameter thickness; |
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| 33 | /// Nlayers |
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| 34 | // [DEFAULT]=Nlayers=20.0 |
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| 35 | Parameter Nlayers; |
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| 36 | /// spacing |
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| 37 | // [DEFAULT]=spacing=250.0 [A] |
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| 38 | Parameter spacing; |
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| 39 | /// poly-dispersity of spacing |
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| 40 | // [DEFAULT]=pd_spacing=0.0 |
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| 41 | Parameter pd_spacing; |
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| 42 | /// layer scrattering length density[1/A^(2)] |
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| 43 | // [DEFAULT]=sld_layer=1.0e-6 [1/A^(2)] |
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| 44 | Parameter sld_layer; |
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| 45 | /// solvent scrattering length density[1/A^(2)] |
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| 46 | // [DEFAULT]=sld_solvent=6.34e-6 [1/A^(2)] |
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| 47 | Parameter sld_solvent; |
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| 48 | /// Incoherent Background [1/cm] 0.00 |
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| 49 | // [DEFAULT]=background=0.0 [1/cm] |
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| 50 | Parameter background; |
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| 51 | |
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| 52 | // Constructor |
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| 53 | LamellarPCrystalModel(); |
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| 54 | |
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| 55 | // Operators to get I(Q) |
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| 56 | double operator()(double q); |
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| 57 | double operator()(double qx, double qy); |
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| 58 | double calculate_ER(); |
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[6319646] | 59 | double calculate_VR(); |
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[503a972] | 60 | double evaluate_rphi(double q, double phi); |
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| 61 | }; |
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| 62 | |
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| 63 | #endif |
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