source: sasview/sansmodels/src/sans/models/c_extensions/StickyHS.h @ 1aaa579

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Last change on this file since 1aaa579 was 5eb9154, checked in by Jae Cho <jhjcho@…>, 15 years ago

calculation of the effective radius are added

  • Property mode set to 100644
File size: 1.7 KB
Line 
1#if !defined(StickyHS_h)
2#define StickyHS_h
3
4/**
5 * Structure definition for StickyHS_struct (struncture factor) parameters
6 */
7 //[PYTHONCLASS] = StickyHSStructure
8 //[DISP_PARAMS] = effect_radius
9 //[DESCRIPTION] =<text> Structure Factor for interacting particles:                               .
10 //
11 //  The interaction potential is
12 //
13 //                     U(r)= inf , r < 2R
14 //                         = -Uo  , 2R < r < 2R + w
15 //                         = 0   , r >= 2R +w
16 //
17 //                                             R: effective radius of the hardsphere
18 //                     stickiness = [exp(Uo/kT)]/(12*perturb)
19 //                     perturb = w/(w+ 2R) , 0.01 =< w <= 0.1
20 //                     w: The width of the square well ,w > 0
21 //                                             v: The volume fraction , v > 0
22 //
23 //                     Ref: Menon, S. V. G.,et.al., J. Chem.
24 //                      Phys., 1991, 95(12), 9186-9190.
25 //                             </text>
26 //[FIXED]= effect_radius.width
27typedef struct {
28    /// effect radius of hardsphere [A]
29    //  [DEFAULT]=effect_radius=50.0 [A]
30    double effect_radius;
31
32    /// Volume fraction
33    //  [DEFAULT]=volfraction= 0.1
34    double volfraction;
35
36        /// Perturbation Parameter ( between 0.01 - 0.1)
37    //  [DEFAULT]=perturb=0.05
38    double perturb;
39
40    /// Stickiness
41    //  [DEFAULT]=stickiness= 0.2
42    double stickiness;
43} StickyHSParameters;
44
45
46
47/// 1D scattering function
48double StickyHS_analytical_1D(StickyHSParameters *pars, double q);
49
50/// 2D scattering function
51double StickyHS_analytical_2D(StickyHSParameters *pars, double q, double phi);
52double StickyHS_analytical_2DXY(StickyHSParameters *pars, double qx, double qy);
53
54#endif
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