[503a972] | 1 | #if !defined(spheroid_h) |
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| 2 | #define spheroid_h |
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| 3 | #include "parameters.hh" |
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| 4 | |
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| 5 | /** Structure definition for oblate parameters |
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| 6 | * [PYTHONCLASS] = CoreShellEllipsoidModel |
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| 7 | * [DISP_PARAMS] = equat_core, polar_core, equat_shell,polar_shell,axis_phi, axis_theta |
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| 8 | [DESCRIPTION] = <text>[SpheroidCoreShellModel] Calculates the form factor for an spheroid |
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| 9 | ellipsoid particle with a core_shell structure. |
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| 10 | The form factor is averaged over all possible |
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| 11 | orientations of the ellipsoid such that P(q) |
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| 12 | = scale*<f^2>/Vol + bkg, where f is the |
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| 13 | single particle scattering amplitude. |
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| 14 | [Parameters]: |
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| 15 | equat_core = equatorial radius of core, |
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| 16 | polar_core = polar radius of core, |
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| 17 | equat_shell = equatorial radius of shell, |
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| 18 | polar_shell = polar radius (revolution axis) of shell, |
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| 19 | sld_core = SLD_core |
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| 20 | sld_shell = SLD_shell |
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| 21 | sld_solvent = SLD_solvent |
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| 22 | background = Incoherent bkg |
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| 23 | scale =scale |
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| 24 | Note:It is the users' responsibility to ensure |
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| 25 | that shell radii are larger than core radii. |
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| 26 | oblate: polar radius < equatorial radius |
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| 27 | prolate : polar radius > equatorial radius |
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| 28 | </text> |
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| 29 | |
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| 30 | [FIXED] = <text>equat_core.width;polar_core.width; equat_shell.width; polar_shell.width; axis_phi.width; axis_theta.width</text> |
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| 31 | [ORIENTATION_PARAMS]= <text>axis_phi; axis_theta; axis_phi.width; axis_theta.width</text> |
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| 32 | |
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| 33 | **/ |
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| 34 | |
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| 35 | class CoreShellEllipsoidModel{ |
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| 36 | public: |
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| 37 | // Model parameters |
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| 38 | /// Scale factor |
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| 39 | // [DEFAULT]=scale=1.0 |
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| 40 | Parameter scale; |
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| 41 | /// Equatorial radius of core [A] |
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| 42 | // [DEFAULT]=equat_core=200.0 [A] |
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| 43 | Parameter equat_core; |
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| 44 | /// Polar radius of core [A] |
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| 45 | // [DEFAULT]=polar_core=20.0 [A] |
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| 46 | Parameter polar_core; |
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| 47 | /// equatorial radius of shell [A] |
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| 48 | // [DEFAULT]=equat_shell=250.0 [A] |
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| 49 | Parameter equat_shell; |
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| 50 | /// polar radius of shell [A] |
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| 51 | // [DEFAULT]=polar_shell=30.0 [A] |
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| 52 | Parameter polar_shell; |
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| 53 | /// Core scattering length density [1/A^(2)] |
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| 54 | // [DEFAULT]=sld_core=2.0e-6 [1/A^(2)] |
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| 55 | Parameter sld_core; |
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| 56 | /// Shell scattering length density [1/A^(2)] |
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| 57 | // [DEFAULT]=sld_shell=1.0e-6 [1/A^(2)] |
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| 58 | Parameter sld_shell; |
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| 59 | /// Solvent scattering length density [1/A^(2)] |
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| 60 | // [DEFAULT]=sld_solvent=6.3e-6 [1/A^(2)] |
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| 61 | Parameter sld_solvent; |
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| 62 | /// Incoherent Background [1/cm] 0.001 |
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| 63 | // [DEFAULT]=background=0.001 [1/cm] |
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| 64 | Parameter background; |
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| 65 | //Disable for now |
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| 66 | /// Orientation of the oblate axis w/respect incoming beam [deg] |
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| 67 | // [DEFAULT]=axis_theta=0.0 [deg] |
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| 68 | Parameter axis_theta; |
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| 69 | /// Orientation of the oblate in the plane of the detector [deg] |
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| 70 | // [DEFAULT]=axis_phi=0.0 [deg] |
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| 71 | Parameter axis_phi; |
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| 72 | |
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| 73 | // Constructor |
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| 74 | CoreShellEllipsoidModel(); |
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| 75 | |
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| 76 | // Operators to get I(Q) |
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| 77 | double operator()(double q); |
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| 78 | double operator()(double qx, double qy); |
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| 79 | double calculate_ER(); |
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[6319646] | 80 | double calculate_VR(); |
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[503a972] | 81 | double evaluate_rphi(double q, double phi); |
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| 82 | }; |
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| 83 | |
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| 84 | #endif |
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