1 | #if !defined(o_h) |
---|
2 | #define refl_h |
---|
3 | |
---|
4 | /** |
---|
5 | * Structure definition for sphere parameters |
---|
6 | */ |
---|
7 | //[PYTHONCLASS] = ReflModel |
---|
8 | //[DISP_PARAMS] = thick_inter0 |
---|
9 | //[DESCRIPTION] =<text>Form factor of mutishells normalized by the volume. Here each shell is described |
---|
10 | // by an exponential function; |
---|
11 | // I) |
---|
12 | // For A_shell != 0, |
---|
13 | // f(r) = B*exp(A_shell*(r-r_in)/thick_shell)+C |
---|
14 | // where |
---|
15 | // B=(sld_out-sld_in)/(exp(A_shell)-1) |
---|
16 | // C=sld_in-B. |
---|
17 | // Note that in the above case, |
---|
18 | // the function becomes a linear function |
---|
19 | // as A_shell --> 0+ or 0-. |
---|
20 | // II) |
---|
21 | // For the exact point of A_shell == 0, |
---|
22 | // f(r) = sld_in ,i.e., it crosses over flat function |
---|
23 | // Note that the 'sld_out' becaomes NULL in this case. |
---|
24 | // |
---|
25 | // background:background, |
---|
26 | // rad_core: radius of sphere(core) |
---|
27 | // thick_shell#:the thickness of the shell# |
---|
28 | // sld_core: the SLD of the sphere |
---|
29 | // sld_solv: the SLD of the solvent |
---|
30 | // sld_shell: the SLD of the shell# |
---|
31 | // A_shell#: the coefficient in the exponential function |
---|
32 | // </text> |
---|
33 | //[FIXED]= <text></text> |
---|
34 | //[NON_FITTABLE_PARAMS]= <text>n_layers;func_inter0;func_inter1;func_inter2;func_inter3;func_inter4;func_inter5;func_inter5;func_inter7;func_inter8;func_inter9;func_inter10 </text> |
---|
35 | //[ORIENTATION_PARAMS]= <text> </text> |
---|
36 | |
---|
37 | typedef struct { |
---|
38 | /// number of layers |
---|
39 | // [DEFAULT]=n_layers=1 |
---|
40 | int n_layers; |
---|
41 | /// Scale factor |
---|
42 | // [DEFAULT]=scale= 1.0 |
---|
43 | double scale; |
---|
44 | /// thick_inter0 [A] |
---|
45 | // [DEFAULT]=thick_inter0=1.0 [A] |
---|
46 | double thick_inter0; |
---|
47 | /// func_inter0 |
---|
48 | // [DEFAULT]=func_inter0= 0 |
---|
49 | double func_inter0; |
---|
50 | /// sld_sub0 [1/A^(2)] |
---|
51 | // [DEFAULT]=sld_sub0= 2.07e-6 [1/A^(2)] |
---|
52 | double sld_sub0; |
---|
53 | /// sld_medium [1/A^(2)] |
---|
54 | // [DEFAULT]=sld_medium= 1.0e-6 [1/A^(2)] |
---|
55 | double sld_medium; |
---|
56 | /// Background |
---|
57 | // [DEFAULT]=background=0 |
---|
58 | double background; |
---|
59 | |
---|
60 | // [DEFAULT]=sld_flat1=4.0e-06 [1/A^(2)] |
---|
61 | double sld_flat1; |
---|
62 | // [DEFAULT]=sld_flat2=3.5e-06 [1/A^(2)] |
---|
63 | double sld_flat2; |
---|
64 | // [DEFAULT]=sld_flat3=4.0e-06 [1/A^(2)] |
---|
65 | double sld_flat3; |
---|
66 | // [DEFAULT]=sld_flat4=3.5e-06 [1/A^(2)] |
---|
67 | double sld_flat4; |
---|
68 | // [DEFAULT]=sld_flat5=4.0e-06 [1/A^(2)] |
---|
69 | double sld_flat5; |
---|
70 | // [DEFAULT]=sld_flat6=3.5e-06 [1/A^(2)] |
---|
71 | double sld_flat6; |
---|
72 | // [DEFAULT]=sld_flat7=4.0e-06 [1/A^(2)] |
---|
73 | double sld_flat7; |
---|
74 | // [DEFAULT]=sld_flat8=3.5e-06 [1/A^(2)] |
---|
75 | double sld_flat8; |
---|
76 | // [DEFAULT]=sld_flat9=4.0e-06 [1/A^(2)] |
---|
77 | double sld_flat9; |
---|
78 | // [DEFAULT]=sld_flat10=3.5e-06 [1/A^(2)] |
---|
79 | double sld_flat10; |
---|
80 | |
---|
81 | // [DEFAULT]=thick_inter1=1 [A] |
---|
82 | double thick_inter1; |
---|
83 | // [DEFAULT]=thick_inter2=1 [A] |
---|
84 | double thick_inter2; |
---|
85 | // [DEFAULT]=thick_inter3=1 [A] |
---|
86 | double thick_inter3; |
---|
87 | // [DEFAULT]=thick_inter4=1 [A] |
---|
88 | double thick_inter4; |
---|
89 | // [DEFAULT]=thick_inter5=1 [A] |
---|
90 | double thick_inter5; |
---|
91 | // [DEFAULT]=thick_inter6=1 [A] |
---|
92 | double thick_inter6; |
---|
93 | // [DEFAULT]=thick_inter7=1 [A] |
---|
94 | double thick_inter7; |
---|
95 | // [DEFAULT]=thick_inter8=1 [A] |
---|
96 | double thick_inter8; |
---|
97 | // [DEFAULT]=thick_inter9=1 [A] |
---|
98 | double thick_inter9; |
---|
99 | // [DEFAULT]=thick_inter10=1 [A] |
---|
100 | double thick_inter10; |
---|
101 | |
---|
102 | // [DEFAULT]=thick_flat1=10 [A] |
---|
103 | double thick_flat1; |
---|
104 | // [DEFAULT]=thick_flat2=100 [A] |
---|
105 | double thick_flat2; |
---|
106 | // [DEFAULT]=thick_flat3=100 [A] |
---|
107 | double thick_flat3; |
---|
108 | // [DEFAULT]=thick_flat4=100 [A] |
---|
109 | double thick_flat4; |
---|
110 | // [DEFAULT]=thick_flat5=100 [A] |
---|
111 | double thick_flat5; |
---|
112 | // [DEFAULT]=thick_flat6=100 [A] |
---|
113 | double thick_flat6; |
---|
114 | // [DEFAULT]=thick_flat7=100 [A] |
---|
115 | double thick_flat7; |
---|
116 | // [DEFAULT]=thick_flat8=100 [A] |
---|
117 | double thick_flat8; |
---|
118 | // [DEFAULT]=thick_flat9=100 [A] |
---|
119 | double thick_flat9; |
---|
120 | // [DEFAULT]=thick_flat10=100 [A] |
---|
121 | double thick_flat10; |
---|
122 | |
---|
123 | // [DEFAULT]=func_inter1=0 |
---|
124 | double func_inter1; |
---|
125 | // [DEFAULT]=func_inter2=0 |
---|
126 | double func_inter2; |
---|
127 | // [DEFAULT]=func_inter3=0 |
---|
128 | double func_inter3; |
---|
129 | // [DEFAULT]=func_inter4=0 |
---|
130 | double func_inter4; |
---|
131 | // [DEFAULT]=func_inter5=0 |
---|
132 | double func_inter5; |
---|
133 | // [DEFAULT]=func_inter6=0 |
---|
134 | double func_inter6; |
---|
135 | // [DEFAULT]=func_inter7=0 |
---|
136 | double func_inter7; |
---|
137 | // [DEFAULT]=func_inter8=0 |
---|
138 | double func_inter8; |
---|
139 | // [DEFAULT]=func_inter9=0 |
---|
140 | double func_inter9; |
---|
141 | // [DEFAULT]=func_inter10=0 |
---|
142 | double func_inter10; |
---|
143 | |
---|
144 | // [DEFAULT]=sldIM_flat1=0 |
---|
145 | double sldIM_flat1; |
---|
146 | // [DEFAULT]=sldIM_flat2=0 |
---|
147 | double sldIM_flat2; |
---|
148 | // [DEFAULT]=sldIM_flat3=0 |
---|
149 | double sldIM_flat3; |
---|
150 | // [DEFAULT]=sldIM_flat4=0 |
---|
151 | double sldIM_flat4; |
---|
152 | // [DEFAULT]=sldIM_flat5=0 |
---|
153 | double sldIM_flat5; |
---|
154 | // [DEFAULT]=sldIM_flat6=0 |
---|
155 | double sldIM_flat6; |
---|
156 | // [DEFAULT]=sldIM_flat7=0 |
---|
157 | double sldIM_flat7; |
---|
158 | // [DEFAULT]=sldIM_flat8=0 |
---|
159 | double sldIM_flat8; |
---|
160 | // [DEFAULT]=sldIM_flat9=0 |
---|
161 | double sldIM_flat9; |
---|
162 | // [DEFAULT]=sldIM_flat10=0 |
---|
163 | double sldIM_flat10; |
---|
164 | // [DEFAULT]=sldIM_sub0=0 |
---|
165 | double sldIM_sub0; |
---|
166 | // [DEFAULT]=sldIM_medium=0 |
---|
167 | double sldIM_medium; |
---|
168 | |
---|
169 | } ReflParameters; |
---|
170 | |
---|
171 | double re_kernel(double dq[], double q); |
---|
172 | |
---|
173 | /// 1D scattering function |
---|
174 | double refl_analytical_1D(ReflParameters *pars, double q); |
---|
175 | |
---|
176 | /// 2D scattering function |
---|
177 | double refl_analytical_2D(ReflParameters *pars, double q, double phi); |
---|
178 | double refl_analytical_2DXY(ReflParameters *pars, double qx, double qy); |
---|
179 | |
---|
180 | #endif |
---|