models.hh @ 353f467

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Last change on this file since 353f467 was 13eb1c4, checked in by Jae Cho <jhjcho@…>, 15 years ago
updated sld parameters according to the changes in NIST lib: missed it in the last commit
Property mode set to `100644`
File size: 14.5 KB

Rev	Line
[fca6936]	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"
[8a48713]	21	#include "parallelepiped.h"
[c1c29b6]	22	#include "lamellarPS.h"
	23	#include "lamellar.h"
[c724ccd]	24	#include "fuzzysphere.h"
[fca6936]	25	}
	26
	27	using namespace std;
	28
[af03ddd]	29	class CylinderModel{
[fca6936]	30	public:
	31	// Model parameters
	32	Parameter radius;
	33	Parameter scale;
	34	Parameter length;
[f10063e]	35	Parameter sldCyl;
	36	Parameter sldSolv;
[fca6936]	37	Parameter background;
	38	Parameter cyl_theta;
	39	Parameter cyl_phi;
	40
	41	// Constructor
[af03ddd]	42	CylinderModel();
[fca6936]	43
	44	// Operators to get I(Q)
	45	double operator()(double q);
	46	double operator()(double qx, double qy);
[5eb9154]	47	double calculate_ER();
[fca6936]	48	double evaluate_rphi(double q, double phi);
	49	};
	50
[8a48713]	51	class ParallelepipedModel{
	52	public:
[975ec8e]	53	// TODO: add 2D
[8a48713]	54	// Model parameters
	55	Parameter scale;
[2cb89e7]	56	Parameter short_a;
[8e36cdd]	57	Parameter short_b;
	58	Parameter long_c;
[f10063e]	59	Parameter sldPipe;
	60	Parameter sldSolv;
[8a48713]	61	Parameter background;
	62	Parameter parallel_theta;
	63	Parameter parallel_phi;
[975ec8e]	64	Parameter parallel_psi;
[8a48713]	65
	66	// Constructor
	67	ParallelepipedModel();
	68
	69	// Operators to get I(Q)
	70	double operator()(double q);
	71	double operator()(double qx, double qy);
[5eb9154]	72	double calculate_ER();
[8a48713]	73	double evaluate_rphi(double q, double phi);
	74	};
	75
	76
[0f5bc9f]	77	class SphereModel{
	78	public:
	79	// Model parameters
	80	Parameter radius;
	81	Parameter scale;
[f10063e]	82	Parameter sldSph;
	83	Parameter sldSolv;
[0f5bc9f]	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);
[5eb9154]	92	double calculate_ER();
[0f5bc9f]	93	double evaluate_rphi(double q, double phi);
	94	};
	95
[c724ccd]	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
[25579e8]	116	class HardsphereStructure{
	117	public:
	118	// Model parameters
[5eb9154]	119	Parameter effect_radius;
[25579e8]	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);
[5eb9154]	128	double calculate_ER();
[25579e8]	129	double evaluate_rphi(double q, double phi);
	130	};
	131
	132	class StickyHSStructure{
	133	public:
	134	// Model parameters
[5eb9154]	135	Parameter effect_radius;
[25579e8]	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);
[5eb9154]	146	double calculate_ER();
[25579e8]	147	double evaluate_rphi(double q, double phi);
	148	};
	149
	150	class SquareWellStructure{
	151	public:
	152	// Model parameters
[5eb9154]	153	Parameter effect_radius;
[25579e8]	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);
[5eb9154]	164	double calculate_ER();
[25579e8]	165	double evaluate_rphi(double q, double phi);
	166	};
	167
	168	class HayterMSAStructure{
	169	public:
	170	// Model parameters
[5eb9154]	171	Parameter effect_radius;
[25579e8]	172	Parameter charge;
	173	Parameter volfraction;
	174	Parameter temperature;
	175	Parameter saltconc;
	176	Parameter dielectconst;
[a0782f1]	177
[25579e8]	178	// Constructor
	179	HayterMSAStructure();
	180
	181	// Operators to get I(Q)
	182	double operator()(double q);
	183	double operator()(double qx, double qy);
[5eb9154]	184	double calculate_ER();
[25579e8]	185	double evaluate_rphi(double q, double phi);
	186	};
	187
[a0782f1]	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);
[5eb9154]	200	double calculate_ER();
[a0782f1]	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);
[5eb9154]	216	double calculate_ER();
[a0782f1]	217	double evaluate_rphi(double q, double phi);
	218	};
	219
[0f5bc9f]	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);
[5eb9154]	237	double calculate_ER();
[0f5bc9f]	238	double evaluate_rphi(double q, double phi);
	239	};
	240
[c724ccd]	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
[0f5bc9f]	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);
[5eb9154]	288	double calculate_ER();
[0f5bc9f]	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;
[f10063e]	298	Parameter sldEll;
	299	Parameter sldSolv;
[0f5bc9f]	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);
[5eb9154]	310	double calculate_ER();
[0f5bc9f]	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;
[f10063e]	321	Parameter sldCyl;
	322	Parameter sldSolv;
[0f5bc9f]	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);
[5eb9154]	334	double calculate_ER();
[0f5bc9f]	335	double evaluate_rphi(double q, double phi);
	336	};
[5068697]	337	class TriaxialEllipsoidModel{
	338	public:
	339	// Model parameters
	340	Parameter scale;
	341	Parameter semi_axisA;
	342	Parameter semi_axisB;
	343	Parameter semi_axisC;
[13eb1c4]	344	Parameter sldEll;
	345	Parameter sldSolv;
[5068697]	346	Parameter background;
	347	Parameter axis_theta;
	348	Parameter axis_phi;
[975ec8e]	349	Parameter axis_psi;
	350
[5068697]	351	// Constructor
	352	TriaxialEllipsoidModel();
	353
	354	// Operators to get I(Q)
	355	double operator()(double q);
	356	double operator()(double qx, double qy);
[5eb9154]	357	double calculate_ER();
[5068697]	358	double evaluate_rphi(double q, double phi);
	359	};
	360
	361	class FlexibleCylinderModel{
	362	public:
	363	// Model parameters
	364	Parameter scale;
	365	Parameter length;
	366	Parameter kuhn_length;
	367	Parameter radius;
[f10063e]	368	Parameter sldCyl;
	369	Parameter sldSolv;
[5068697]	370	Parameter background;
[975ec8e]	371
[5068697]	372	// Constructor
	373	FlexibleCylinderModel();
	374
	375	// Operators to get I(Q)
	376	double operator()(double q);
	377	double operator()(double qx, double qy);
[5eb9154]	378	double calculate_ER();
[5068697]	379	double evaluate_rphi(double q, double phi);
	380	};
	381
[c724ccd]	382	class FlexCylEllipXModel{
	383	public:
	384	// Model parameters
	385	Parameter scale;
	386	Parameter length;
	387	Parameter kuhn_length;
	388	Parameter radius;
	389	Parameter axis_ratio;
	390	Parameter sldCyl;
	391	Parameter sldSolv;
	392	Parameter background;
	393
	394	// Constructor
	395	FlexCylEllipXModel();
	396
	397	// Operators to get I(Q)
	398	double operator()(double q);
	399	double operator()(double qx, double qy);
	400	double calculate_ER();
	401	double evaluate_rphi(double q, double phi);
	402	};
	403
[5068697]	404	class StackedDisksModel{
	405	public:
	406	// Model parameters
	407	Parameter scale;
[975ec8e]	408	Parameter core_thick;
[5068697]	409	Parameter radius;
[975ec8e]	410	Parameter layer_thick;
[5068697]	411	Parameter core_sld;
	412	Parameter layer_sld;
	413	Parameter solvent_sld;
[975ec8e]	414	Parameter n_stacking;
	415	Parameter sigma_d;
[5068697]	416	Parameter background;
	417	Parameter axis_theta;
	418	Parameter axis_phi;
[975ec8e]	419
[5068697]	420	// Constructor
	421	StackedDisksModel();
	422
	423	// Operators to get I(Q)
	424	double operator()(double q);
	425	double operator()(double qx, double qy);
[5eb9154]	426	double calculate_ER();
[5068697]	427	double evaluate_rphi(double q, double phi);
	428	};
[27a0771]	429
[34c3020]	430	class LamellarModel{
	431	public:
	432	// Model parameters
	433	Parameter scale;
[975ec8e]	434	Parameter bi_thick;
	435	Parameter sld_bi;
	436	Parameter sld_sol;
[34c3020]	437	Parameter background;
[975ec8e]	438
[34c3020]	439	// Constructor
	440	LamellarModel();
	441
	442	// Operators to get I(Q)
	443	double operator()(double q);
	444	double operator()(double qx, double qy);
[5eb9154]	445	double calculate_ER();
[34c3020]	446	double evaluate_rphi(double q, double phi);
	447
	448	};
	449
	450	class LamellarFFHGModel{
	451	public:
	452	// Model parameters
	453	Parameter scale;
	454	Parameter t_length;
	455	Parameter h_thickness;
	456	Parameter sld_tail;
	457	Parameter sld_head;
	458	Parameter sld_solvent;
	459	Parameter background;
[975ec8e]	460
[34c3020]	461	// Constructor
	462	LamellarFFHGModel();
	463
	464	// Operators to get I(Q)
	465	double operator()(double q);
	466	double operator()(double qx, double qy);
[5eb9154]	467	double calculate_ER();
[34c3020]	468	double evaluate_rphi(double q, double phi);
	469
	470	};
	471
	472
	473
[27a0771]	474	class LamellarPSModel{
	475	public:
	476	// Model parameters
	477	Parameter scale;
	478	Parameter spacing;
	479	Parameter delta;
[f10063e]	480	Parameter sld_bi;
	481	Parameter sld_sol;
[27a0771]	482	Parameter n_plates;
	483	Parameter caille;
	484	Parameter background;
[975ec8e]	485
[27a0771]	486	// Constructor
	487	LamellarPSModel();
	488
	489	// Operators to get I(Q)
	490	double operator()(double q);
	491	double operator()(double qx, double qy);
[5eb9154]	492	double calculate_ER();
[27a0771]	493	double evaluate_rphi(double q, double phi);
	494	};
	495
	496	class LamellarPSHGModel{
	497	public:
	498	// Model parameters
	499	Parameter scale;
	500	Parameter spacing;
	501	Parameter deltaT;
	502	Parameter deltaH;
	503	Parameter sld_tail;
	504	Parameter sld_head;
	505	Parameter sld_solvent;
	506	Parameter n_plates;
	507	Parameter caille;
	508	Parameter background;
[975ec8e]	509
[27a0771]	510	// Constructor
	511	LamellarPSHGModel();
	512
	513	// Operators to get I(Q)
	514	double operator()(double q);
	515	double operator()(double qx, double qy);
[5eb9154]	516	double calculate_ER();
[27a0771]	517	double evaluate_rphi(double q, double phi);
	518	};
	519
[eddff027]	520	class CoreShellEllipsoidModel{
[975ec8e]	521	public:
	522	// Model parameters
	523	Parameter scale;
	524	Parameter equat_core;
	525	Parameter polar_core;
	526	Parameter equat_shell;
	527	Parameter polar_shell;
[f10063e]	528	Parameter sld_core;
	529	Parameter sld_shell;
[975ec8e]	530	Parameter sld_solvent;
	531	Parameter background;
	532	Parameter axis_theta;
	533	Parameter axis_phi;
	534
	535	// Constructor
[eddff027]	536	CoreShellEllipsoidModel();
[975ec8e]	537
	538	// Operators to get I(Q)
	539	double operator()(double q);
	540	double operator()(double qx, double qy);
[5eb9154]	541	double calculate_ER();
[975ec8e]	542	double evaluate_rphi(double q, double phi);
	543	};
	544
[27fea3f]	545	class HollowCylinderModel{
	546	public:
	547	// Model parameters
	548	Parameter scale;
	549	Parameter core_radius;
[e2afadf]	550	Parameter radius;
[27fea3f]	551	Parameter length;
[f10063e]	552	Parameter sldCyl;
	553	Parameter sldSolv;
[27fea3f]	554	Parameter background;
	555	Parameter axis_theta;
	556	Parameter axis_phi;
[975ec8e]	557
[27fea3f]	558	//Constructor
	559	HollowCylinderModel();
[975ec8e]	560
[27fea3f]	561	//Operators to get I(Q)
	562	double operator()(double q);
	563	double operator()(double qx , double qy);
[5eb9154]	564	double calculate_ER();
[27fea3f]	565	double evaluate_rphi(double q, double phi);
	566	};
[3d25331f]	567
	568	class MultiShellModel{
	569	public:
	570	// Model parameters
	571	Parameter scale;
	572	Parameter core_radius;
	573	Parameter s_thickness;
	574	Parameter w_thickness;
	575	Parameter core_sld;
	576	Parameter shell_sld;
	577	Parameter n_pairs;
	578	Parameter background;
[975ec8e]	579
[3d25331f]	580	//Constructor
	581	MultiShellModel();
[975ec8e]	582
[3d25331f]	583	//Operators to get I(Q)
	584	double operator()(double q);
	585	double operator()(double qx , double qy);
[5eb9154]	586	double calculate_ER();
[3d25331f]	587	double evaluate_rphi(double q, double phi);
	588	};
	589
	590	class VesicleModel{
	591	public:
	592	// Model parameters
	593	Parameter scale;
[e2afadf]	594	Parameter radius;
[3d25331f]	595	Parameter thickness;
	596	Parameter core_sld;
	597	Parameter shell_sld;
	598	Parameter background;
[975ec8e]	599
[3d25331f]	600	//Constructor
	601	VesicleModel();
[975ec8e]	602
[3d25331f]	603	//Operators to get I(Q)
	604	double operator()(double q);
	605	double operator()(double qx , double qy);
[5eb9154]	606	double calculate_ER();
[3d25331f]	607	double evaluate_rphi(double q, double phi);
	608	};
	609
	610	class BinaryHSModel{
	611	public:
	612	// Model parameters
	613	Parameter l_radius;
	614	Parameter s_radius;
	615	Parameter vol_frac_ls;
	616	Parameter vol_frac_ss;
	617	Parameter ls_sld;
	618	Parameter ss_sld;
	619	Parameter solvent_sld;
	620	Parameter background;
[975ec8e]	621
[3d25331f]	622	//Constructor
	623	BinaryHSModel();
[975ec8e]	624
[3d25331f]	625	//Operators to get I(Q)
	626	double operator()(double q);
	627	double operator()(double qx , double qy);
[5eb9154]	628	double calculate_ER();
[3d25331f]	629	double evaluate_rphi(double q, double phi);
	630	};
	631
[2c4b289]	632	class BinaryHSPSF11Model{
	633	public:
	634	// Model parameters
	635	Parameter l_radius;
	636	Parameter s_radius;
	637	Parameter vol_frac_ls;
	638	Parameter vol_frac_ss;
	639	Parameter ls_sld;
	640	Parameter ss_sld;
	641	Parameter solvent_sld;
	642	Parameter background;
[975ec8e]	643
[2c4b289]	644	//Constructor
	645	BinaryHSPSF11Model();
[975ec8e]	646
[2c4b289]	647	//Operators to get I(Q)
	648	double operator()(double q);
	649	double operator()(double qx , double qy);
[5eb9154]	650	double calculate_ER();
[2c4b289]	651	double evaluate_rphi(double q, double phi);
	652	};
	653
[c724ccd]	654	class Poly_GaussCoil{
	655	public:
	656	// Model parameters
	657	Parameter rg;
	658	Parameter scale;
	659	Parameter poly_m;
	660	Parameter background;
	661
	662	// Constructor
	663	Poly_GaussCoil();
	664
	665	// Operators to get I(Q)
	666	double operator()(double q);
	667	double operator()(double qx, double qy);
	668	double calculate_ER();
	669	double evaluate_rphi(double q, double phi);
	670	};
	671
	672	class FractalModel{
	673	public:
	674	// Model parameters
	675	Parameter radius;
	676	Parameter scale;
	677	Parameter fractal_dim;
	678	Parameter cor_length;
	679	Parameter sldBlock;
	680	Parameter sldSolv;
	681	Parameter background;
	682
	683	// Constructor
	684	FractalModel();
	685
	686	// Operators to get I(Q)
	687	double operator()(double q);
	688	double operator()(double qx, double qy);
	689	double calculate_ER();
	690	double evaluate_rphi(double q, double phi);
	691	};
	692
	693	/***
	694	class PolymerExclVolModel{
	695	public:
	696	// Model parameters
	697	Parameter rg;
	698	Parameter scale;
	699	Parameter m;
	700	Parameter background;
	701
	702	// Constructor
	703	PolymerExclVolModel();
	704
	705	// Operators to get I(Q)
	706	double operator()(double q);
	707	double operator()(double qx, double qy);
	708	double calculate_ER();
	709	double evaluate_rphi(double q, double phi);
	710	};
	711	***/
[fca6936]	712	#endif

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SasView

source: sasview/sansmodels/src/sans/models/c_models/models.hh @ 353f467

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