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Minor fix to the McXtrace sasmodels generator: There should be no "th…
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…eta" var in TRACE, defined elsewhere.
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willend committed Feb 13, 2024
1 parent eb708cb commit 3e9d3f3
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Showing 94 changed files with 94 additions and 100 deletions.
2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels-generator/sasmodels2mcxtrace.py
Original file line number Diff line number Diff line change
Expand Up @@ -574,7 +574,7 @@ def generate_indiv_files():
TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, Theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
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2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels/SasView_adsorbed_layer.comp
Original file line number Diff line number Diff line change
Expand Up @@ -174,7 +174,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
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2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels/SasView_barbell.comp
Original file line number Diff line number Diff line change
Expand Up @@ -834,7 +834,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels/SasView_barbell_aniso.comp
Original file line number Diff line number Diff line change
Expand Up @@ -840,7 +840,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels/SasView_bcc_paracrystal.comp
Original file line number Diff line number Diff line change
Expand Up @@ -692,7 +692,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
Original file line number Diff line number Diff line change
Expand Up @@ -701,7 +701,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels/SasView_binary_hard_sphere.comp
Original file line number Diff line number Diff line change
Expand Up @@ -374,7 +374,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels/SasView_broad_peak.comp
Original file line number Diff line number Diff line change
Expand Up @@ -161,7 +161,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels/SasView_capped_cylinder.comp
Original file line number Diff line number Diff line change
Expand Up @@ -839,7 +839,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
Original file line number Diff line number Diff line change
Expand Up @@ -845,7 +845,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels/SasView_core_multi_shell.comp
Original file line number Diff line number Diff line change
Expand Up @@ -268,7 +268,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels/SasView_core_shell_bicelle.comp
Original file line number Diff line number Diff line change
Expand Up @@ -858,7 +858,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
Original file line number Diff line number Diff line change
Expand Up @@ -864,7 +864,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
Original file line number Diff line number Diff line change
Expand Up @@ -885,7 +885,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
Original file line number Diff line number Diff line change
Expand Up @@ -894,7 +894,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
Original file line number Diff line number Diff line change
Expand Up @@ -904,7 +904,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
Original file line number Diff line number Diff line change
Expand Up @@ -913,7 +913,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels/SasView_core_shell_cylinder.comp
Original file line number Diff line number Diff line change
Expand Up @@ -804,7 +804,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
Original file line number Diff line number Diff line change
Expand Up @@ -810,7 +810,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels/SasView_core_shell_ellipsoid.comp
Original file line number Diff line number Diff line change
Expand Up @@ -550,7 +550,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
Original file line number Diff line number Diff line change
Expand Up @@ -556,7 +556,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
Original file line number Diff line number Diff line change
Expand Up @@ -574,7 +574,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
Original file line number Diff line number Diff line change
Expand Up @@ -583,7 +583,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels/SasView_core_shell_sphere.comp
Original file line number Diff line number Diff line change
Expand Up @@ -294,7 +294,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels/SasView_correlation_length.comp
Original file line number Diff line number Diff line change
Expand Up @@ -156,7 +156,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels/SasView_cylinder.comp
Original file line number Diff line number Diff line change
Expand Up @@ -779,7 +779,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels/SasView_cylinder_aniso.comp
Original file line number Diff line number Diff line change
Expand Up @@ -785,7 +785,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels/SasView_dab.comp
Original file line number Diff line number Diff line change
Expand Up @@ -139,7 +139,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels/SasView_ellipsoid.comp
Original file line number Diff line number Diff line change
Expand Up @@ -489,7 +489,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels/SasView_ellipsoid_aniso.comp
Original file line number Diff line number Diff line change
Expand Up @@ -495,7 +495,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels/SasView_elliptical_cylinder.comp
Original file line number Diff line number Diff line change
Expand Up @@ -820,7 +820,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
Original file line number Diff line number Diff line change
Expand Up @@ -829,7 +829,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels/SasView_fcc_paracrystal.comp
Original file line number Diff line number Diff line change
Expand Up @@ -658,7 +658,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
Original file line number Diff line number Diff line change
Expand Up @@ -667,7 +667,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels/SasView_flexible_cylinder.comp
Original file line number Diff line number Diff line change
Expand Up @@ -765,7 +765,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
Original file line number Diff line number Diff line change
Expand Up @@ -1000,7 +1000,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
5 changes: 1 addition & 4 deletions mcxtrace-comps/sasmodels/SasView_fractal.comp
Original file line number Diff line number Diff line change
Expand Up @@ -85,9 +85,6 @@ SETTING PARAMETERS (


SHARE %{
#ifdef OPENACC
#define USE_CUDA
#endif
%include "sas_kernel_header.c"

/* BEGIN Required header for SASmodel fractal */
Expand Down Expand Up @@ -444,7 +441,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
5 changes: 1 addition & 4 deletions mcxtrace-comps/sasmodels/SasView_fractal_core_shell.comp
Original file line number Diff line number Diff line change
Expand Up @@ -91,9 +91,6 @@ SETTING PARAMETERS (


SHARE %{
#ifdef OPENACC
#define USE_CUDA
#endif
%include "sas_kernel_header.c"

/* BEGIN Required header for SASmodel fractal_core_shell */
Expand Down Expand Up @@ -502,7 +499,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels/SasView_fuzzy_sphere.comp
Original file line number Diff line number Diff line change
Expand Up @@ -234,7 +234,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels/SasView_gauss_lorentz_gel.comp
Original file line number Diff line number Diff line change
Expand Up @@ -156,7 +156,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
Expand Down
2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels/SasView_gaussian_peak.comp
Original file line number Diff line number Diff line change
Expand Up @@ -138,7 +138,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
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2 changes: 1 addition & 1 deletion mcxtrace-comps/sasmodels/SasView_gel_fit.comp
Original file line number Diff line number Diff line change
Expand Up @@ -165,7 +165,7 @@ if (xwidth && yheight && zdepth)

TRACE
%{
double l0, l1, k, l_full, l, dl, d_Phi, theta;
double l0, l1, k, l_full, l, dl, d_Phi;
double aim_x=0, aim_y=0, aim_z=1, axis_x, axis_y, axis_z;
double f, solid_angle, kx_i, ky_i, kz_i, q, qx, qy, qz;
char intersect=0;
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