models.hh @ 2339ff1e

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Last change on this file since 2339ff1e was c1c29b6, checked in by Jae Cho <jhjcho@…>, 15 years ago
some corrections and removed polydispersity from inside of function and set dQ =0
Property mode set to `100644`
File size: 12.0 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"
[fca6936]	24	}
	25
	26	using namespace std;
	27
[af03ddd]	28	class CylinderModel{
[fca6936]	29	public:
	30	// Model parameters
	31	Parameter radius;
	32	Parameter scale;
	33	Parameter length;
	34	Parameter contrast;
	35	Parameter background;
	36	Parameter cyl_theta;
	37	Parameter cyl_phi;
	38
	39	// Constructor
[af03ddd]	40	CylinderModel();
[fca6936]	41
	42	// Operators to get I(Q)
	43	double operator()(double q);
	44	double operator()(double qx, double qy);
	45	double evaluate_rphi(double q, double phi);
	46	};
	47
[8a48713]	48	class ParallelepipedModel{
	49	public:
[975ec8e]	50	// TODO: add 2D
[8a48713]	51	// Model parameters
	52	Parameter scale;
[2cb89e7]	53	Parameter short_a;
[8e36cdd]	54	Parameter short_b;
	55	Parameter long_c;
[8a48713]	56	Parameter contrast;
	57	Parameter background;
	58	Parameter parallel_theta;
	59	Parameter parallel_phi;
[975ec8e]	60	Parameter parallel_psi;
[8a48713]	61
	62	// Constructor
	63	ParallelepipedModel();
	64
	65	// Operators to get I(Q)
	66	double operator()(double q);
	67	double operator()(double qx, double qy);
	68	double evaluate_rphi(double q, double phi);
	69	};
	70
	71
[0f5bc9f]	72	class SphereModel{
	73	public:
	74	// Model parameters
	75	Parameter radius;
	76	Parameter scale;
	77	Parameter contrast;
	78	Parameter background;
	79
	80	// Constructor
	81	SphereModel();
	82
	83	// Operators to get I(Q)
	84	double operator()(double q);
	85	double operator()(double qx, double qy);
	86	double evaluate_rphi(double q, double phi);
	87	};
	88
[25579e8]	89	class HardsphereStructure{
	90	public:
	91	// Model parameters
	92	Parameter radius;
	93	Parameter volfraction;
	94
	95	// Constructor
	96	HardsphereStructure();
	97
	98	// Operators to get I(Q)
	99	double operator()(double q);
	100	double operator()(double qx, double qy);
	101	double evaluate_rphi(double q, double phi);
	102	};
	103
	104	class StickyHSStructure{
	105	public:
	106	// Model parameters
	107	Parameter radius;
	108	Parameter volfraction;
	109	Parameter perturb;
	110	Parameter stickiness;
	111
	112	// Constructor
	113	StickyHSStructure();
	114
	115	// Operators to get I(Q)
	116	double operator()(double q);
	117	double operator()(double qx, double qy);
	118	double evaluate_rphi(double q, double phi);
	119	};
	120
	121	class SquareWellStructure{
	122	public:
	123	// Model parameters
	124	Parameter radius;
	125	Parameter volfraction;
	126	Parameter welldepth;
	127	Parameter wellwidth;
	128
	129	// Constructor
	130	SquareWellStructure();
	131
	132	// Operators to get I(Q)
	133	double operator()(double q);
	134	double operator()(double qx, double qy);
	135	double evaluate_rphi(double q, double phi);
	136	};
	137
	138	class HayterMSAStructure{
	139	public:
	140	// Model parameters
	141	Parameter radius;
	142	Parameter charge;
	143	Parameter volfraction;
	144	Parameter temperature;
	145	Parameter saltconc;
	146	Parameter dielectconst;
[a0782f1]	147
[25579e8]	148	// Constructor
	149	HayterMSAStructure();
	150
	151	// Operators to get I(Q)
	152	double operator()(double q);
	153	double operator()(double qx, double qy);
	154	double evaluate_rphi(double q, double phi);
	155	};
	156
[a0782f1]	157	class DiamEllipFunc{
	158	public:
	159	// Model parameters
	160	Parameter radius_a;
	161	Parameter radius_b;
	162
	163	// Constructor
	164	DiamEllipFunc();
	165
	166	// Operators to get I(Q)
	167	double operator()(double q);
	168	double operator()(double qx, double qy);
	169	double evaluate_rphi(double q, double phi);
	170	};
	171
	172	class DiamCylFunc{
	173	public:
	174	// Model parameters
	175	Parameter radius;
	176	Parameter length;
	177
	178	// Constructor
	179	DiamCylFunc();
	180
	181	// Operators to get I(Q)
	182	double operator()(double q);
	183	double operator()(double qx, double qy);
	184	double evaluate_rphi(double q, double phi);
	185	};
	186
[0f5bc9f]	187	class CoreShellModel{
	188	public:
	189	// Model parameters
	190	Parameter radius;
	191	Parameter scale;
	192	Parameter thickness;
	193	Parameter core_sld;
	194	Parameter shell_sld;
	195	Parameter solvent_sld;
	196	Parameter background;
	197
	198	// Constructor
	199	CoreShellModel();
	200
	201	// Operators to get I(Q)
	202	double operator()(double q);
	203	double operator()(double qx, double qy);
	204	double evaluate_rphi(double q, double phi);
	205	};
	206
	207	class CoreShellCylinderModel{
	208	public:
	209	// Model parameters
	210	Parameter radius;
	211	Parameter scale;
	212	Parameter thickness;
	213	Parameter length;
	214	Parameter core_sld;
	215	Parameter shell_sld;
	216	Parameter solvent_sld;
	217	Parameter background;
	218	Parameter axis_theta;
	219	Parameter axis_phi;
	220
	221	// Constructor
	222	CoreShellCylinderModel();
	223
	224	// Operators to get I(Q)
	225	double operator()(double q);
	226	double operator()(double qx, double qy);
	227	double evaluate_rphi(double q, double phi);
	228	};
	229
	230	class EllipsoidModel{
	231	public:
	232	// Model parameters
	233	Parameter radius_a;
	234	Parameter scale;
	235	Parameter radius_b;
	236	Parameter contrast;
	237	Parameter background;
	238	Parameter axis_theta;
	239	Parameter axis_phi;
	240
	241	// Constructor
	242	EllipsoidModel();
	243
	244	// Operators to get I(Q)
	245	double operator()(double q);
	246	double operator()(double qx, double qy);
	247	double evaluate_rphi(double q, double phi);
	248	};
	249
	250	class EllipticalCylinderModel{
	251	public:
	252	// Model parameters
	253	Parameter r_minor;
	254	Parameter scale;
	255	Parameter r_ratio;
	256	Parameter length;
	257	Parameter contrast;
	258	Parameter background;
	259	Parameter cyl_theta;
	260	Parameter cyl_phi;
	261	Parameter cyl_psi;
	262
	263	// Constructor
	264	EllipticalCylinderModel();
	265
	266	// Operators to get I(Q)
	267	double operator()(double q);
	268	double operator()(double qx, double qy);
	269	double evaluate_rphi(double q, double phi);
	270	};
[5068697]	271	class TriaxialEllipsoidModel{
	272	public:
	273	// Model parameters
	274	Parameter scale;
	275	Parameter semi_axisA;
	276	Parameter semi_axisB;
	277	Parameter semi_axisC;
	278	Parameter contrast;
	279	Parameter background;
	280	Parameter axis_theta;
	281	Parameter axis_phi;
[975ec8e]	282	Parameter axis_psi;
	283
[5068697]	284	// Constructor
	285	TriaxialEllipsoidModel();
	286
	287	// Operators to get I(Q)
	288	double operator()(double q);
	289	double operator()(double qx, double qy);
	290	double evaluate_rphi(double q, double phi);
	291	};
	292
	293	class FlexibleCylinderModel{
	294	public:
	295	// Model parameters
	296	Parameter scale;
	297	Parameter length;
	298	Parameter kuhn_length;
	299	Parameter radius;
	300	Parameter contrast;
	301	Parameter background;
	302	Parameter axis_theta;
	303	Parameter axis_phi;
[975ec8e]	304
[5068697]	305	// Constructor
	306	FlexibleCylinderModel();
	307
	308	// Operators to get I(Q)
	309	double operator()(double q);
	310	double operator()(double qx, double qy);
	311	double evaluate_rphi(double q, double phi);
	312	};
	313
	314	class StackedDisksModel{
	315	public:
	316	// Model parameters
	317	Parameter scale;
[975ec8e]	318	Parameter core_thick;
[5068697]	319	Parameter radius;
[975ec8e]	320	Parameter layer_thick;
[5068697]	321	Parameter core_sld;
	322	Parameter layer_sld;
	323	Parameter solvent_sld;
[975ec8e]	324	Parameter n_stacking;
	325	Parameter sigma_d;
[5068697]	326	Parameter background;
	327	Parameter axis_theta;
	328	Parameter axis_phi;
[975ec8e]	329
[5068697]	330	// Constructor
	331	StackedDisksModel();
	332
	333	// Operators to get I(Q)
	334	double operator()(double q);
	335	double operator()(double qx, double qy);
	336	double evaluate_rphi(double q, double phi);
	337	};
[27a0771]	338
[34c3020]	339	class LamellarModel{
	340	public:
	341	// Model parameters
	342	Parameter scale;
[975ec8e]	343	Parameter bi_thick;
	344	Parameter sld_bi;
	345	Parameter sld_sol;
[34c3020]	346	Parameter background;
[975ec8e]	347
[34c3020]	348	// Constructor
	349	LamellarModel();
	350
	351	// Operators to get I(Q)
	352	double operator()(double q);
	353	double operator()(double qx, double qy);
	354	double evaluate_rphi(double q, double phi);
	355
	356	};
	357
	358	class LamellarFFHGModel{
	359	public:
	360	// Model parameters
	361	Parameter scale;
	362	Parameter t_length;
	363	Parameter h_thickness;
	364	Parameter sld_tail;
	365	Parameter sld_head;
	366	Parameter sld_solvent;
	367	Parameter background;
[975ec8e]	368
[34c3020]	369	// Constructor
	370	LamellarFFHGModel();
	371
	372	// Operators to get I(Q)
	373	double operator()(double q);
	374	double operator()(double qx, double qy);
	375	double evaluate_rphi(double q, double phi);
	376
	377	};
	378
	379
	380
[27a0771]	381	class LamellarPSModel{
	382	public:
	383	// Model parameters
	384	Parameter scale;
	385	Parameter spacing;
	386	Parameter delta;
	387	Parameter contrast;
	388	Parameter n_plates;
	389	Parameter caille;
	390	Parameter background;
[975ec8e]	391
[27a0771]	392	// Constructor
	393	LamellarPSModel();
	394
	395	// Operators to get I(Q)
	396	double operator()(double q);
	397	double operator()(double qx, double qy);
	398	double evaluate_rphi(double q, double phi);
	399	};
	400
	401	class LamellarPSHGModel{
	402	public:
	403	// Model parameters
	404	Parameter scale;
	405	Parameter spacing;
	406	Parameter deltaT;
	407	Parameter deltaH;
	408	Parameter sld_tail;
	409	Parameter sld_head;
	410	Parameter sld_solvent;
	411	Parameter n_plates;
	412	Parameter caille;
	413	Parameter background;
[975ec8e]	414
[27a0771]	415	// Constructor
	416	LamellarPSHGModel();
	417
	418	// Operators to get I(Q)
	419	double operator()(double q);
	420	double operator()(double qx, double qy);
	421	double evaluate_rphi(double q, double phi);
	422	};
	423
[eddff027]	424	class CoreShellEllipsoidModel{
[975ec8e]	425	public:
	426	// Model parameters
	427	Parameter scale;
	428	Parameter equat_core;
	429	Parameter polar_core;
	430	Parameter equat_shell;
	431	Parameter polar_shell;
	432	Parameter contrast;
	433	Parameter sld_solvent;
	434	Parameter background;
	435	Parameter axis_theta;
	436	Parameter axis_phi;
	437
	438	// Constructor
[eddff027]	439	CoreShellEllipsoidModel();
[975ec8e]	440
	441	// Operators to get I(Q)
	442	double operator()(double q);
	443	double operator()(double qx, double qy);
	444	double evaluate_rphi(double q, double phi);
	445	};
	446
[27a0771]	447	class OblateModel{
	448	public:
	449	// Model parameters
	450	Parameter scale;
	451	Parameter major_core;
	452	Parameter minor_core;
	453	Parameter major_shell;
	454	Parameter minor_shell;
	455	Parameter contrast;
	456	Parameter sld_solvent;
	457	Parameter background;
	458	Parameter axis_theta;
	459	Parameter axis_phi;
[975ec8e]	460
[27a0771]	461	// Constructor
	462	OblateModel();
	463
	464	// Operators to get I(Q)
	465	double operator()(double q);
	466	double operator()(double qx, double qy);
	467	double evaluate_rphi(double q, double phi);
	468	};
	469	class ProlateModel{
	470	public:
	471	// Model parameters
	472	Parameter scale;
	473	Parameter major_core;
	474	Parameter minor_core;
	475	Parameter major_shell;
	476	Parameter minor_shell;
	477	Parameter contrast;
	478	Parameter sld_solvent;
	479	Parameter background;
	480	Parameter axis_theta;
	481	Parameter axis_phi;
[975ec8e]	482
[27a0771]	483	// Constructor
	484	ProlateModel();
	485
	486	// Operators to get I(Q)
	487	double operator()(double q);
	488	double operator()(double qx, double qy);
	489	double evaluate_rphi(double q, double phi);
	490	};
[27fea3f]	491	class HollowCylinderModel{
	492	public:
	493	// Model parameters
	494	Parameter scale;
	495	Parameter core_radius;
	496	Parameter shell_radius;
	497	Parameter length;
	498	Parameter contrast;
	499	Parameter background;
	500	Parameter axis_theta;
	501	Parameter axis_phi;
[975ec8e]	502
[27fea3f]	503	//Constructor
	504	HollowCylinderModel();
[975ec8e]	505
[27fea3f]	506	//Operators to get I(Q)
	507	double operator()(double q);
	508	double operator()(double qx , double qy);
	509	double evaluate_rphi(double q, double phi);
	510	};
[3d25331f]	511
	512	class MultiShellModel{
	513	public:
	514	// Model parameters
	515	Parameter scale;
	516	Parameter core_radius;
	517	Parameter s_thickness;
	518	Parameter w_thickness;
	519	Parameter core_sld;
	520	Parameter shell_sld;
	521	Parameter n_pairs;
	522	Parameter background;
[975ec8e]	523
[3d25331f]	524	//Constructor
	525	MultiShellModel();
[975ec8e]	526
[3d25331f]	527	//Operators to get I(Q)
	528	double operator()(double q);
	529	double operator()(double qx , double qy);
	530	double evaluate_rphi(double q, double phi);
	531	};
	532
	533	class VesicleModel{
	534	public:
	535	// Model parameters
	536	Parameter scale;
	537	Parameter core_radius;
	538	Parameter thickness;
	539	Parameter core_sld;
	540	Parameter shell_sld;
	541	Parameter background;
[975ec8e]	542
[3d25331f]	543	//Constructor
	544	VesicleModel();
[975ec8e]	545
[3d25331f]	546	//Operators to get I(Q)
	547	double operator()(double q);
	548	double operator()(double qx , double qy);
	549	double evaluate_rphi(double q, double phi);
	550	};
	551
	552	class BinaryHSModel{
	553	public:
	554	// Model parameters
	555	Parameter l_radius;
	556	Parameter s_radius;
	557	Parameter vol_frac_ls;
	558	Parameter vol_frac_ss;
	559	Parameter ls_sld;
	560	Parameter ss_sld;
	561	Parameter solvent_sld;
	562	Parameter background;
[975ec8e]	563
[3d25331f]	564	//Constructor
	565	BinaryHSModel();
[975ec8e]	566
[3d25331f]	567	//Operators to get I(Q)
	568	double operator()(double q);
	569	double operator()(double qx , double qy);
	570	double evaluate_rphi(double q, double phi);
	571	};
	572
[2c4b289]	573	class BinaryHSPSF11Model{
	574	public:
	575	// Model parameters
	576	Parameter l_radius;
	577	Parameter s_radius;
	578	Parameter vol_frac_ls;
	579	Parameter vol_frac_ss;
	580	Parameter ls_sld;
	581	Parameter ss_sld;
	582	Parameter solvent_sld;
	583	Parameter background;
[975ec8e]	584
[2c4b289]	585	//Constructor
	586	BinaryHSPSF11Model();
[975ec8e]	587
[2c4b289]	588	//Operators to get I(Q)
	589	double operator()(double q);
	590	double operator()(double qx , double qy);
	591	double evaluate_rphi(double q, double phi);
	592	};
	593
[fca6936]	594	#endif

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