/*******************************************************************************
*
* McStas, neutron ray-tracing package
*         Copyright (C) 1997-2008, All rights reserved
*         Risoe National Laboratory, Roskilde, Denmark
*         Institut Laue Langevin, Grenoble, France
*
* Component: Sans_spheres
*
* %I
* Written by: P. Willendrup, K. Lefmann, L. Arleth, L. Udby
* Date: 19.12.2003
* Version: $Revision: 1.11 $
* Origin: Risoe
* Release: McStas 1.12
* Modified by: KL, 7 June 2005
*
*
* %D
* Sample for Small Angle Neutron Scattering - spherical shells in thin solution with gaussian size distribution
* The shape of the sample may be a cylinder of given radius or a box with dimensions
* xwidth, yheight, zthick. qmax defines a cutoff in q.
*
* Example: Sans_spheres(R = 100, dR = 5, dbilayer=35, Phi = 1e-3, Delta_rho = 0.6, sigma_a = 50, qmax = 0.3 ,xwidth=0.01, yheight=0.01, zthick=0.005)
*
* %BUGS
* This component does NOT simulate absolute intensities. This latter depends on the detector parameters.
*
* %P
*
* INPUT PARAMETERS
*
* R:         Radius of scattering hard spheres (AA)
* polydisp:  Polydispersity of R
* dbilayer:  Thickness of shell (AA)
* Phi:       Particle volume fraction (1)
* Delta_rho: Excess scattering length density (fm/AA^3)
* sigma_a:   Absorption cross section density at 2200 m/s (m^-1)
* qmax:      Maximum momentum transfer (AA^-1)
* Rdet:      Detector (disk-shaped) radius (m)
* dist:      Distance from sample to detector (m)
* xwidth:    horiz. dimension of sample, as a width (m)
* yheight:   vert . dimension of sample, as a height (m)
* zthick:    thickness of sample (m)
*
* Variables calculated in the component
*
* my_s: Attenuation factor due to scattering (m^-1)
* my_a: Attenuation factor due to absorbtion (m^-1)
*
* %Link
* The test/example instrument <a href="../examples/SANS.instr">SANS.instr</a>.
%L
* Some alternative implementations exist as contributed components.
* %E
*******************************************************************************/

DEFINE COMPONENT Sans_liposomes_new

SETTING PARAMETERS (R=100,dR=0.0, Phi=1e-3, Delta_rho=0.6, sigma_a=0.50, dist=6, Rdet=0.5 ,xwidth=0.01, yheight=0.01, zthick=0.005, qmax=0, dbilayer=35)

DECLARE
%{
  double my_a_v;
%}
INITIALIZE
%{
    if (!xwidth || !yheight || !zthick) {
  exit(fprintf(stderr,"Sans_spheres: %s:   sample has no volume (zero dimensions)\n", NAME_CURRENT_COMP));
  if (qmax) printf("Sans_spheres: %s: Parameter qmax is not used anymore. Ignoring.\n", NAME_CURRENT_COMP);
    }

  my_a_v = sigma_a*2200*100;           /* Is not yet divided by v. 100: Convert barns -> fm^2 */

  /*my_s_pre = Phi * 4*PI*R*R*R/3 * Delta_rho*Delta_rho;*/

 /*  my_s_pre = 1;*/

%}
TRACE
%{
  double my_s_pre;
  double q_v;
  double q;
  double Ri;
  double Ro;
  double fi;
  double fo;
  double Vi;
  double Vo;

  double t0, t1, v, l_full, l, l_1, dt, d_phi, theta, my_s;
  double aim_x, aim_y, aim_z, axis_x, axis_y, axis_z;
  double arg, tmp_vx, tmp_vy, tmp_vz, vout_x, vout_y, vout_z;
  double f, solid_angle, vx_i, vy_i, vz_i, qx, qy, qz;
  char   intersect=0;
  
  Ro=R+randnorm()*dR;
  Ri = Ro-dbilayer; /*  Calculate inner radius of liposphere */
  if(dbilayer==R)
	  Ri=0; /*  Treat sample as solid spheres */
  Vi = 4/3*PI*Ri*Ri*Ri;
  Vo = 4/3*PI*Ro*Ro*Ro;
  my_s_pre = Phi * (Vo-Vi) * Delta_rho*Delta_rho;

  intersect = box_intersect(&t0, &t1, x, y, z, vx, vy, vz, xwidth, yheight, zthick);
  if(intersect)
  {
    if(t0 < 0)
      ABSORB;
    /* Neutron enters at t=t0. */
    v = sqrt(vx*vx + vy*vy + vz*vz);
    l_full = v * (t1 - t0);             /* Length of full path through sample */
    dt = rand01()*(t1 - t0) + t0; /* Time of scattering */
    PROP_DT(dt);                  /* Point of scattering */
    l = v*(dt-t0);                /* Penetration in sample */

    vx_i=vx;
    vy_i=vy;
    vz_i=vz;
    randvec_target_circle(&vx, &vy, &vz, &solid_angle, 0, 0, dist, Rdet);
/*    printf("solid angle %g \n",solid_angle); */
    NORM(vx, vy, vz);
    vx *= v;
    vy *= v;
    vz *= v;
    qx = V2K*(vx_i-vx);
    qy = V2K*(vy_i-vy);
    qz = V2K*(vz_i-vz);
    q = sqrt(qx*qx+qy*qy+qz*qz);

    /*    f = 3 * (sin(q*R) - q*R*cos(q*R))/(q*R*q*R*q*R);*/
    
    fo = 3*(sin(q*Ro) - q*Ro*cos(q*Ro))/(q*Ro*q*Ro*q*Ro);
    
if(Ri<=0)
    fi = 0;
else
    fi = 3*(sin(q*Ri) - q*Ri*cos(q*Ri))/(q*Ri*q*Ri*q*Ri);
    
    f= (Vo*fo-Vi*fi)/(Vo-Vi);

    if(!box_intersect(&t0, &t1, x, y, z, vx, vy, vz, xwidth, yheight, zthick))    fprintf(stderr, "Sans_spheres: FATAL ERROR: Did not hit box from inside.\n");


    l_1 = v*t1;
/*    fprintf(stderr, "l_full: %g, qmax: %g p: %g my_s_pre: %g, f: %g, my_a_v/v: %g\n",l_full,qmax,p,my_s_pre,f,my_a_v/v);*/
    p *= l_full*solid_angle/(4*PI)*my_s_pre*f*f*exp(-my_a_v*(l+l_1)/v);
    SCATTER;
  }
%}

MCDISPLAY
%{
  double radius = 0;
  double h = 0;
  magnify("xyz");
  {
    double xmin = -0.5*xwidth;
    double xmax =  0.5*xwidth;
    double ymin = -0.5*yheight;
    double ymax =  0.5*yheight;
    double zmin = -0.5*zthick;
    double zmax =  0.5*zthick;
    multiline(5, xmin, ymin, zmin,
                 xmax, ymin, zmin,
                 xmax, ymax, zmin,
                 xmin, ymax, zmin,
                 xmin, ymin, zmin);
    multiline(5, xmin, ymin, zmax,
                 xmax, ymin, zmax,
                 xmax, ymax, zmax,
                 xmin, ymax, zmax,
                 xmin, ymin, zmax);
    line(xmin, ymin, zmin, xmin, ymin, zmax);
    line(xmax, ymin, zmin, xmax, ymin, zmax);
    line(xmin, ymax, zmin, xmin, ymax, zmax);
    line(xmax, ymax, zmin, xmax, ymax, zmax);
  }

%}
END
