models.hh @ 04349fe

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Last change on this file since 04349fe was 261b864, checked in by Jae Cho <jhjcho@…>, 15 years ago
remove poylexclvol.h: not using now
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1	/**
2	This software was developed by the University of Tennessee as part of the
3	Distributed Data Analysis of Neutron Scattering Experiments (DANSE)
4	project funded by the US National Science Foundation.
5
6	If you use DANSE applications to do scientific research that leads to
7	publication, we ask that you acknowledge the use of the software with the
8	following sentence:
9
10	"This work benefited from DANSE software developed under NSF award DMR-0520547."
11
12	copyright 2008, University of Tennessee
13	*/
14	#ifndef MODEL_CLASS_H
15	#define MODEL_CLASS_H
16
17	#include <vector>
18	#include "parameters.hh"
19	extern "C" {
20	#include "cylinder.h"
21	#include "parallelepiped.h"
22	#include "lamellarPS.h"
23	#include "lamellar.h"
24	#include "fuzzysphere.h"
25	}
26
27	using namespace std;
28
29	class CylinderModel{
30	public:
31	// Model parameters
32	Parameter radius;
33	Parameter scale;
34	Parameter length;
35	Parameter sldCyl;
36	Parameter sldSolv;
37	Parameter background;
38	Parameter cyl_theta;
39	Parameter cyl_phi;
40
41	// Constructor
42	CylinderModel();
43
44	// Operators to get I(Q)
45	double operator()(double q);
46	double operator()(double qx, double qy);
47	double calculate_ER();
48	double evaluate_rphi(double q, double phi);
49	};
50
51	class ParallelepipedModel{
52	public:
53	// TODO: add 2D
54	// Model parameters
55	Parameter scale;
56	Parameter short_a;
57	Parameter short_b;
58	Parameter long_c;
59	Parameter sldPipe;
60	Parameter sldSolv;
61	Parameter background;
62	Parameter parallel_theta;
63	Parameter parallel_phi;
64	Parameter parallel_psi;
65
66	// Constructor
67	ParallelepipedModel();
68
69	// Operators to get I(Q)
70	double operator()(double q);
71	double operator()(double qx, double qy);
72	double calculate_ER();
73	double evaluate_rphi(double q, double phi);
74	};
75
76
77	class SphereModel{
78	public:
79	// Model parameters
80	Parameter radius;
81	Parameter scale;
82	Parameter sldSph;
83	Parameter sldSolv;
84	Parameter background;
85
86	// Constructor
87	SphereModel();
88
89	// Operators to get I(Q)
90	double operator()(double q);
91	double operator()(double qx, double qy);
92	double calculate_ER();
93	double evaluate_rphi(double q, double phi);
94	};
95
96	class FuzzySphereModel{
97	public:
98	// Model parameters
99	Parameter radius;
100	Parameter scale;
101	Parameter fuzziness;
102	Parameter sldSph;
103	Parameter sldSolv;
104	Parameter background;
105
106	// Constructor
107	FuzzySphereModel();
108
109	// Operators to get I(Q)
110	double operator()(double q);
111	double operator()(double qx, double qy);
112	double calculate_ER();
113	double evaluate_rphi(double q, double phi);
114	};
115
116	class HardsphereStructure{
117	public:
118	// Model parameters
119	Parameter effect_radius;
120	Parameter volfraction;
121
122	// Constructor
123	HardsphereStructure();
124
125	// Operators to get I(Q)
126	double operator()(double q);
127	double operator()(double qx, double qy);
128	double calculate_ER();
129	double evaluate_rphi(double q, double phi);
130	};
131
132	class StickyHSStructure{
133	public:
134	// Model parameters
135	Parameter effect_radius;
136	Parameter volfraction;
137	Parameter perturb;
138	Parameter stickiness;
139
140	// Constructor
141	StickyHSStructure();
142
143	// Operators to get I(Q)
144	double operator()(double q);
145	double operator()(double qx, double qy);
146	double calculate_ER();
147	double evaluate_rphi(double q, double phi);
148	};
149
150	class SquareWellStructure{
151	public:
152	// Model parameters
153	Parameter effect_radius;
154	Parameter volfraction;
155	Parameter welldepth;
156	Parameter wellwidth;
157
158	// Constructor
159	SquareWellStructure();
160
161	// Operators to get I(Q)
162	double operator()(double q);
163	double operator()(double qx, double qy);
164	double calculate_ER();
165	double evaluate_rphi(double q, double phi);
166	};
167
168	class HayterMSAStructure{
169	public:
170	// Model parameters
171	Parameter effect_radius;
172	Parameter charge;
173	Parameter volfraction;
174	Parameter temperature;
175	Parameter saltconc;
176	Parameter dielectconst;
177
178	// Constructor
179	HayterMSAStructure();
180
181	// Operators to get I(Q)
182	double operator()(double q);
183	double operator()(double qx, double qy);
184	double calculate_ER();
185	double evaluate_rphi(double q, double phi);
186	};
187
188	class DiamEllipFunc{
189	public:
190	// Model parameters
191	Parameter radius_a;
192	Parameter radius_b;
193
194	// Constructor
195	DiamEllipFunc();
196
197	// Operators to get I(Q)
198	double operator()(double q);
199	double operator()(double qx, double qy);
200	double calculate_ER();
201	double evaluate_rphi(double q, double phi);
202	};
203
204	class DiamCylFunc{
205	public:
206	// Model parameters
207	Parameter radius;
208	Parameter length;
209
210	// Constructor
211	DiamCylFunc();
212
213	// Operators to get I(Q)
214	double operator()(double q);
215	double operator()(double qx, double qy);
216	double calculate_ER();
217	double evaluate_rphi(double q, double phi);
218	};
219
220	class CoreShellModel{
221	public:
222	// Model parameters
223	Parameter radius;
224	Parameter scale;
225	Parameter thickness;
226	Parameter core_sld;
227	Parameter shell_sld;
228	Parameter solvent_sld;
229	Parameter background;
230
231	// Constructor
232	CoreShellModel();
233
234	// Operators to get I(Q)
235	double operator()(double q);
236	double operator()(double qx, double qy);
237	double calculate_ER();
238	double evaluate_rphi(double q, double phi);
239	};
240
241	class CoreFourShellModel{
242	public:
243	// Model parameters
244	Parameter scale;
245	Parameter rad_core;
246	Parameter sld_core;
247	Parameter thick_shell1;
248	Parameter sld_shell1;
249	Parameter thick_shell2;
250	Parameter sld_shell2;
251	Parameter thick_shell3;
252	Parameter sld_shell3;
253	Parameter thick_shell4;
254	Parameter sld_shell4;
255	Parameter sld_solv;
256	Parameter background;
257
258	// Constructor
259	CoreFourShellModel();
260
261	// Operators to get I(Q)
262	double operator()(double q);
263	double operator()(double qx, double qy);
264	double calculate_ER();
265	double evaluate_rphi(double q, double phi);
266	};
267
268	class CoreShellCylinderModel{
269	public:
270	// Model parameters
271	Parameter radius;
272	Parameter scale;
273	Parameter thickness;
274	Parameter length;
275	Parameter core_sld;
276	Parameter shell_sld;
277	Parameter solvent_sld;
278	Parameter background;
279	Parameter axis_theta;
280	Parameter axis_phi;
281
282	// Constructor
283	CoreShellCylinderModel();
284
285	// Operators to get I(Q)
286	double operator()(double q);
287	double operator()(double qx, double qy);
288	double calculate_ER();
289	double evaluate_rphi(double q, double phi);
290	};
291
292	class EllipsoidModel{
293	public:
294	// Model parameters
295	Parameter radius_a;
296	Parameter scale;
297	Parameter radius_b;
298	Parameter sldEll;
299	Parameter sldSolv;
300	Parameter background;
301	Parameter axis_theta;
302	Parameter axis_phi;
303
304	// Constructor
305	EllipsoidModel();
306
307	// Operators to get I(Q)
308	double operator()(double q);
309	double operator()(double qx, double qy);
310	double calculate_ER();
311	double evaluate_rphi(double q, double phi);
312	};
313
314	class EllipticalCylinderModel{
315	public:
316	// Model parameters
317	Parameter r_minor;
318	Parameter scale;
319	Parameter r_ratio;
320	Parameter length;
321	Parameter sldCyl;
322	Parameter sldSolv;
323	Parameter background;
324	Parameter cyl_theta;
325	Parameter cyl_phi;
326	Parameter cyl_psi;
327
328	// Constructor
329	EllipticalCylinderModel();
330
331	// Operators to get I(Q)
332	double operator()(double q);
333	double operator()(double qx, double qy);
334	double calculate_ER();
335	double evaluate_rphi(double q, double phi);
336	};
337	class TriaxialEllipsoidModel{
338	public:
339	// Model parameters
340	Parameter scale;
341	Parameter semi_axisA;
342	Parameter semi_axisB;
343	Parameter semi_axisC;
344	Parameter contrast;
345	Parameter background;
346	Parameter axis_theta;
347	Parameter axis_phi;
348	Parameter axis_psi;
349
350	// Constructor
351	TriaxialEllipsoidModel();
352
353	// Operators to get I(Q)
354	double operator()(double q);
355	double operator()(double qx, double qy);
356	double calculate_ER();
357	double evaluate_rphi(double q, double phi);
358	};
359
360	class FlexibleCylinderModel{
361	public:
362	// Model parameters
363	Parameter scale;
364	Parameter length;
365	Parameter kuhn_length;
366	Parameter radius;
367	Parameter sldCyl;
368	Parameter sldSolv;
369	Parameter background;
370
371	// Constructor
372	FlexibleCylinderModel();
373
374	// Operators to get I(Q)
375	double operator()(double q);
376	double operator()(double qx, double qy);
377	double calculate_ER();
378	double evaluate_rphi(double q, double phi);
379	};
380
381	class FlexCylEllipXModel{
382	public:
383	// Model parameters
384	Parameter scale;
385	Parameter length;
386	Parameter kuhn_length;
387	Parameter radius;
388	Parameter axis_ratio;
389	Parameter sldCyl;
390	Parameter sldSolv;
391	Parameter background;
392
393	// Constructor
394	FlexCylEllipXModel();
395
396	// Operators to get I(Q)
397	double operator()(double q);
398	double operator()(double qx, double qy);
399	double calculate_ER();
400	double evaluate_rphi(double q, double phi);
401	};
402
403	class StackedDisksModel{
404	public:
405	// Model parameters
406	Parameter scale;
407	Parameter core_thick;
408	Parameter radius;
409	Parameter layer_thick;
410	Parameter core_sld;
411	Parameter layer_sld;
412	Parameter solvent_sld;
413	Parameter n_stacking;
414	Parameter sigma_d;
415	Parameter background;
416	Parameter axis_theta;
417	Parameter axis_phi;
418
419	// Constructor
420	StackedDisksModel();
421
422	// Operators to get I(Q)
423	double operator()(double q);
424	double operator()(double qx, double qy);
425	double calculate_ER();
426	double evaluate_rphi(double q, double phi);
427	};
428
429	class LamellarModel{
430	public:
431	// Model parameters
432	Parameter scale;
433	Parameter bi_thick;
434	Parameter sld_bi;
435	Parameter sld_sol;
436	Parameter background;
437
438	// Constructor
439	LamellarModel();
440
441	// Operators to get I(Q)
442	double operator()(double q);
443	double operator()(double qx, double qy);
444	double calculate_ER();
445	double evaluate_rphi(double q, double phi);
446
447	};
448
449	class LamellarFFHGModel{
450	public:
451	// Model parameters
452	Parameter scale;
453	Parameter t_length;
454	Parameter h_thickness;
455	Parameter sld_tail;
456	Parameter sld_head;
457	Parameter sld_solvent;
458	Parameter background;
459
460	// Constructor
461	LamellarFFHGModel();
462
463	// Operators to get I(Q)
464	double operator()(double q);
465	double operator()(double qx, double qy);
466	double calculate_ER();
467	double evaluate_rphi(double q, double phi);
468
469	};
470
471
472
473	class LamellarPSModel{
474	public:
475	// Model parameters
476	Parameter scale;
477	Parameter spacing;
478	Parameter delta;
479	Parameter sld_bi;
480	Parameter sld_sol;
481	Parameter n_plates;
482	Parameter caille;
483	Parameter background;
484
485	// Constructor
486	LamellarPSModel();
487
488	// Operators to get I(Q)
489	double operator()(double q);
490	double operator()(double qx, double qy);
491	double calculate_ER();
492	double evaluate_rphi(double q, double phi);
493	};
494
495	class LamellarPSHGModel{
496	public:
497	// Model parameters
498	Parameter scale;
499	Parameter spacing;
500	Parameter deltaT;
501	Parameter deltaH;
502	Parameter sld_tail;
503	Parameter sld_head;
504	Parameter sld_solvent;
505	Parameter n_plates;
506	Parameter caille;
507	Parameter background;
508
509	// Constructor
510	LamellarPSHGModel();
511
512	// Operators to get I(Q)
513	double operator()(double q);
514	double operator()(double qx, double qy);
515	double calculate_ER();
516	double evaluate_rphi(double q, double phi);
517	};
518
519	class CoreShellEllipsoidModel{
520	public:
521	// Model parameters
522	Parameter scale;
523	Parameter equat_core;
524	Parameter polar_core;
525	Parameter equat_shell;
526	Parameter polar_shell;
527	Parameter sld_core;
528	Parameter sld_shell;
529	Parameter sld_solvent;
530	Parameter background;
531	Parameter axis_theta;
532	Parameter axis_phi;
533
534	// Constructor
535	CoreShellEllipsoidModel();
536
537	// Operators to get I(Q)
538	double operator()(double q);
539	double operator()(double qx, double qy);
540	double calculate_ER();
541	double evaluate_rphi(double q, double phi);
542	};
543
544	class HollowCylinderModel{
545	public:
546	// Model parameters
547	Parameter scale;
548	Parameter core_radius;
549	Parameter radius;
550	Parameter length;
551	Parameter sldCyl;
552	Parameter sldSolv;
553	Parameter background;
554	Parameter axis_theta;
555	Parameter axis_phi;
556
557	//Constructor
558	HollowCylinderModel();
559
560	//Operators to get I(Q)
561	double operator()(double q);
562	double operator()(double qx , double qy);
563	double calculate_ER();
564	double evaluate_rphi(double q, double phi);
565	};
566
567	class MultiShellModel{
568	public:
569	// Model parameters
570	Parameter scale;
571	Parameter core_radius;
572	Parameter s_thickness;
573	Parameter w_thickness;
574	Parameter core_sld;
575	Parameter shell_sld;
576	Parameter n_pairs;
577	Parameter background;
578
579	//Constructor
580	MultiShellModel();
581
582	//Operators to get I(Q)
583	double operator()(double q);
584	double operator()(double qx , double qy);
585	double calculate_ER();
586	double evaluate_rphi(double q, double phi);
587	};
588
589	class VesicleModel{
590	public:
591	// Model parameters
592	Parameter scale;
593	Parameter radius;
594	Parameter thickness;
595	Parameter core_sld;
596	Parameter shell_sld;
597	Parameter background;
598
599	//Constructor
600	VesicleModel();
601
602	//Operators to get I(Q)
603	double operator()(double q);
604	double operator()(double qx , double qy);
605	double calculate_ER();
606	double evaluate_rphi(double q, double phi);
607	};
608
609	class BinaryHSModel{
610	public:
611	// Model parameters
612	Parameter l_radius;
613	Parameter s_radius;
614	Parameter vol_frac_ls;
615	Parameter vol_frac_ss;
616	Parameter ls_sld;
617	Parameter ss_sld;
618	Parameter solvent_sld;
619	Parameter background;
620
621	//Constructor
622	BinaryHSModel();
623
624	//Operators to get I(Q)
625	double operator()(double q);
626	double operator()(double qx , double qy);
627	double calculate_ER();
628	double evaluate_rphi(double q, double phi);
629	};
630
631	class BinaryHSPSF11Model{
632	public:
633	// Model parameters
634	Parameter l_radius;
635	Parameter s_radius;
636	Parameter vol_frac_ls;
637	Parameter vol_frac_ss;
638	Parameter ls_sld;
639	Parameter ss_sld;
640	Parameter solvent_sld;
641	Parameter background;
642
643	//Constructor
644	BinaryHSPSF11Model();
645
646	//Operators to get I(Q)
647	double operator()(double q);
648	double operator()(double qx , double qy);
649	double calculate_ER();
650	double evaluate_rphi(double q, double phi);
651	};
652
653	class Poly_GaussCoil{
654	public:
655	// Model parameters
656	Parameter rg;
657	Parameter scale;
658	Parameter poly_m;
659	Parameter background;
660
661	// Constructor
662	Poly_GaussCoil();
663
664	// Operators to get I(Q)
665	double operator()(double q);
666	double operator()(double qx, double qy);
667	double calculate_ER();
668	double evaluate_rphi(double q, double phi);
669	};
670
671	class FractalModel{
672	public:
673	// Model parameters
674	Parameter radius;
675	Parameter scale;
676	Parameter fractal_dim;
677	Parameter cor_length;
678	Parameter sldBlock;
679	Parameter sldSolv;
680	Parameter background;
681
682	// Constructor
683	FractalModel();
684
685	// Operators to get I(Q)
686	double operator()(double q);
687	double operator()(double qx, double qy);
688	double calculate_ER();
689	double evaluate_rphi(double q, double phi);
690	};
691
692	/***
693	class PolymerExclVolModel{
694	public:
695	// Model parameters
696	Parameter rg;
697	Parameter scale;
698	Parameter m;
699	Parameter background;
700
701	// Constructor
702	PolymerExclVolModel();
703
704	// Operators to get I(Q)
705	double operator()(double q);
706	double operator()(double qx, double qy);
707	double calculate_ER();
708	double evaluate_rphi(double q, double phi);
709	};
710	***/
711	#endif

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