fixed dose display

diff --git a/nlsop.c b/nlsop.c
index 3dafd1bbc746a348f47235eb0bcbd13ae00fa120..712702bd2043b1ce3fdb8a6d3f89b758355f17cb 100644 (file)
--- a/nlsop.c
+++ b/nlsop.c
@@ -404,6 +404,7 @@ int get_c_ratio(double *c_ratio,char *pfile,info *my_info,d3_lattice *d3_l)
   }
  }
  *c_ratio=d/all;
+ close(p_fd);
 
  return 1;
 }
@@ -437,6 +438,7 @@ int main(int argc,char **argv)
  char diff_txt[MAX_TXT];
  char dr_ac_txt[MAX_TXT];
  char dr_cc_txt[MAX_TXT];
+ char dose_txt[MAX_TXT];
  char mode_txt[MAX_TXT];
  char *arg_v[MAX_ARGV];
 #endif
@@ -625,6 +627,7 @@ int main(int argc,char **argv)
 #ifdef USE_DFB_API
  strcpy(a_txt,"args:");
  sprintf(s_txt,"steps: %d",my_info.steps);
+ sprintf(dose_txt,"dose: %.2fe+17 C/cm²",my_info.steps*1.0/(d3_l.max_x*d3_l.max_y*CELL_LENGTH*CELL_LENGTH*1000));
  sprintf(r_txt,"pressure range: %d",my_info.range);
  sprintf(ap_txt,"a_ap: %.2f  b_ap: %.3f",my_info.a_ap,my_info.b_ap);
  sprintf(el_txt,"a_el: %.2f  b_el: %.3f",my_info.a_el,my_info.b_el);
@@ -649,10 +652,10 @@ int main(int argc,char **argv)
  arg_v[12]=zdiff_txt;
  arg_v[13]=NULL;
  arg_v[14]=a_txt;
- arg_v[15]=NULL;
- arg_v[16]=s_txt;
- arg_v[17]=r_txt;
- arg_v[18]=NULL;
+ arg_v[15]=s_txt;
+ arg_v[16]=dose_txt;
+ arg_v[17]=NULL;
+ arg_v[18]=r_txt;
  arg_v[19]=ap_txt;
  arg_v[20]=el_txt;
  arg_v[21]=cd_txt;