source: sasview/sansmodels/src/sans/models/c_extensions/lamellarPS.c @ 0ab485b

/**
 * Scattering model for a lamellar
 * TODO: Add 2D analysis
 */

#include "lamellarPS.h"
#include <math.h>
#include "libCylinder.h"
#include <stdio.h>
#include <stdlib.h>

/*LamellarPS_kernel() was moved from libigor to get rid of polydipersity in del(thickness) that we provide from control panel.
/*      LamellarPSX  :  calculates the form factor of a lamellar structure - with S(q) effects included
-------
------- resolution effects ARE NOT included, but only a CONSTANT default value, not the real q-dependent resolution!!

        */
double
LamellarPS_kernel(double dp[], double q)
{
        double scale,dd,del,contr,NN,Cp,bkg;            //local variables of coefficient wave
        double inten, qval,Pq,Sq,alpha,temp,t1,t2,t3,dQ;
        double Pi,Euler,dQDefault,fii;
        int ii,NNint;
        Euler = 0.5772156649;           // Euler's constant
        dQDefault = 0.0;//0.0025;               //[=] 1/A, q-resolution, default value
        dQ = dQDefault;

        Pi = 4.0*atan(1.0);
        qval = q;

        scale = dp[0];
        dd = dp[1];
        del = dp[2];
        contr = dp[3];
        NN = trunc(dp[4]);              //be sure that NN is an integer
        Cp = dp[5];
        bkg = dp[6];

        Pq = 2.0*contr*contr/qval/qval*(1.0-cos(qval*del));

        NNint = (int)NN;                //cast to an integer for the loop
        ii=0;
        Sq = 0.0;
        for(ii=1;ii<(NNint-1);ii+=1) {

                fii = (double)ii;               //do I really need to do this?

                temp = 0.0;
                alpha = Cp/4.0/Pi/Pi*(log(Pi*ii) + Euler);
                t1 = 2.0*dQ*dQ*dd*dd*alpha;
                t2 = 2.0*qval*qval*dd*dd*alpha;
                t3 = dQ*dQ*dd*dd*ii*ii;

                temp = 1.0-ii/NN;
                temp *= cos(dd*qval*ii/(1.0+t1));
                temp *= exp(-1.0*(t2 + t3)/(2.0*(1.0+t1)) );
                temp /= sqrt(1.0+t1);

                Sq += temp;
        }

        Sq *= 2.0;
        Sq += 1.0;

        inten = 2.0*Pi*scale*Pq*Sq/(dd*qval*qval);

        inten *= 1.0e8;         // 1/A to 1/cm

    return(inten+bkg);
}

/**
 * Function to evaluate 1D scattering function
 * @param pars: parameters of the lamellar
 * @param q: q-value
 * @return: function value
 */
double lamellarPS_analytical_1D(LamellarPSParameters *pars, double q) {
        double dp[7];

        // Fill paramater array
        dp[0] = pars->scale;
        dp[1] = pars->spacing;
        dp[2] = pars->delta;
        dp[3] = pars->contrast;
        dp[4] = pars->n_plates;
        dp[5] = pars->caille;
        dp[6] = pars->background;

        // Call library function to evaluate model
        return LamellarPS_kernel(dp, q);
}
/**
 * Function to evaluate 2D scattering function
 * @param pars: parameters of the lamellar
 * @param q: q-value
 * @return: function value
 */
double lamellarPS_analytical_2DXY(LamellarPSParameters *pars, double qx, double qy) {
        double q;
        q = sqrt(qx*qx+qy*qy);
    return lamellarPS_analytical_1D(pars, q);
}


/**
 * Function to evaluate 2D scattering function
 * @param pars: parameters of the lamellar
 * @param q: q-value
 * @param phi: angle phi
 * @return: function value
 */
double lamellarPS_analytical_2D(LamellarPSParameters *pars, double q, double phi) {
    return lamellarPS_analytical_1D(pars,q);
}

/**
 * Function to evaluate 2D scattering function
 * @param pars: parameters of the lamellar
 * @param q: q-value
 * @param q_x: q_x / q
 * @param q_y: q_y / q
 * @return: function value
 */