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Last change
on this file since e52eeea was
e369627,
checked in by Jae Cho <jhjcho@…>, 14 years ago
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removed some c functions
|
-
Property mode set to
100644
|
File size:
1.3 KB
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Rev | Line | |
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[c724ccd] | 1 | #if !defined(polygausscoil_h) |
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| 2 | #define polygausscoil_h |
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| 3 | |
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| 4 | /** |
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| 5 | * Structure definition for sphere parameters |
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| 6 | */ |
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| 7 | //[PYTHONCLASS] = Poly_GaussCoil |
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| 8 | //[DISP_PARAMS] = rg |
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[8426622] | 9 | //[DESCRIPTION] =<text>I(q)=(scale)*2*[(1+U*x)^(-1/U)+x-1]/[(1+U)*x^2] + background |
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| 10 | // where x = [rg^2*q^2] |
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| 11 | // and the polydispersity is |
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[c724ccd] | 12 | // U = [M_w/M_n]-1. |
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| 13 | // scale = scale factor * volume fraction |
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[8426622] | 14 | // rg = radius of gyration |
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[c724ccd] | 15 | // poly_m = polydispersity of molecular weight |
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[8426622] | 16 | // background = incoherent background |
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[c724ccd] | 17 | // </text> |
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| 18 | //[FIXED]= |
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| 19 | //[ORIENTATION_PARAMS]= <text> </text> |
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| 20 | |
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| 21 | typedef struct { |
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| 22 | /// Scale factor |
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| 23 | // [DEFAULT]=scale= 1.0 |
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| 24 | double scale; |
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| 25 | |
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| 26 | /// Radius of gyration [A] |
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| 27 | // [DEFAULT]=rg=60.0 [A] |
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| 28 | double rg; |
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| 29 | |
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| 30 | /// polydispersity of molecular weight |
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| 31 | // [DEFAULT]=poly_m= 2.0 [Mw/Mn] |
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| 32 | double poly_m; |
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| 33 | |
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| 34 | /// Incoherent Background [1/cm] |
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| 35 | // [DEFAULT]=background=0.001 [1/cm] |
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| 36 | double background; |
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| 37 | } PolyGaussCoilParameters; |
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| 38 | |
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| 39 | |
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| 40 | |
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| 41 | /// 1D scattering function |
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[e369627] | 42 | //double polygausscoil_analytical_1D(PolyGaussCoilParameters *pars, double q); |
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[c724ccd] | 43 | |
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| 44 | /// 2D scattering function |
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[e369627] | 45 | //double polygausscoil_analytical_2D(PolyGaussCoilParameters *pars, double q, double phi); |
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| 46 | //double polygausscoil_analytical_2DXY(PolyGaussCoilParameters *pars, double qx, double qy); |
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[c724ccd] | 47 | |
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| 48 | #endif |
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