if(*(d3_l->status+offset)&AMORPH) count+=1;
}
}
-#ifndef MAC
if(ac_distr==4) dprintf(fd,"%d %d\n",z*CELL_LENGTH,count);
+#ifdef ATPROZ
else dprintf(fd,"%d %f\n",z*CELL_LENGTH,100.0*count/si_count);
+#else
+ else dprintf(fd,"%d %d\n",z*CELL_LENGTH,count/(d3_l->max_x*d3_l->max_y));
#endif
}
close(fd);
int convert_file(char *cf,d3_lattice *d3_l)
{
-#ifndef MAC
int x,y,z;
int c_fd;
}
}
close(c_fd);
-#endif
return 1;
}
return max;
}
+int get_amorphous_layer_info(d3_lattice *d3_l,int *sai,int *sacl,int *eacl) {
+ int i,j,a,oend,nend,count;
+ unsigned char sacl_is_set=0;
+ unsigned char eacl_is_set=0;
+ unsigned char sai_is_set=0;
+
+ a=d3_l->max_x*d3_l->max_y;
+ nend=a;
+ oend=0;
+
+ for(i=0;i<d3_l->max_z;i++) {
+ count=0;
+ for(j=oend;j<nend;j++) if(*(d3_l->status+j)&AMORPH) count++;
+ oend=nend;
+ nend+=a;
+ if((count>=A_START*a)&&(!sai_is_set)) {
+ *sai=i;
+ sai_is_set=1;
+ }
+ if((count>=AC_START*a)&&(!sacl_is_set)) {
+ *sacl=i;
+ sacl_is_set=1;
+ }
+ if((count<=A_END*a)&&(sacl_is_set)&&(!eacl_is_set)) {
+ *eacl=i;
+ eacl_is_set=1;
+ }
+ if((eacl_is_set)&&(count>=A_END*a)) eacl_is_set=0;
+ }
+ return 1;
+}
+
int main(int argc,char **argv)
{
u32 x,y,z,x_c,y_c,z_c;
int i,j,quit,escape,switchmode,nowait,bmp,ac_distr;
int refresh,resave;
int c_step;
+ int sai,sacl,eacl;
char s_file[MAX_CHARS];
char s_file_tmp[MAX_CHARS];
char l_file[MAX_CHARS];
char zdiff_txt[MAX_TXT];
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 hpi_txt[MAX_TXT];
- char csat_txt[MAX_TXT];
+ char srate_txt[MAX_TXT];
+ char start_ai_txt[MAX_TXT];
+ char start_acl_txt[MAX_TXT];
+ char end_acl_txt[MAX_TXT];
char *arg_v[MAX_ARGV];
#endif
d3_lattice d3_l;
info my_info;
unsigned char mode;
- //double c_ratio;
+ double c_ratio;
#ifdef USE_DFB_API
int max_extra;
#endif
u32 *n_e_loss;
u32 ne_max,ip_max;
u32 nel_z;
+ unsigned char do_sputter;
d3_l.max_x=_X;
d3_l.max_y=_Y;
mode=0;
ne_max=0;
ip_max=0;
+ sai=0;
+ sacl=0;
+ eacl=0;
+ do_sputter=1;
#ifdef MORE_PRINTF
printf("reading argv ...");
}
#endif
-#ifdef MORE_PRINTF
- printf("rand init ...");
-#endif
-
+ printf("random api init ...");
if(!strcmp(r_file,"")) rand_init(NULL);
else rand_init(r_file);
-
-#ifdef MORE_PRINTF
printf(" done\n");
- printf("allocating data ...");
-#endif
if(!strcmp(l_file,""))
{
i=d3_l.max_x*d3_l.max_y*d3_l.max_z;
#ifdef USE_DFB_API
+ printf("d3 lattice init ...");
d3_lattice_init(&argc,argv,&d3_l);
+ printf(" done\n");
#endif
if((d3_l.status=(unsigned char *)malloc(i*sizeof(unsigned char)))==NULL)
{
memset(d3_l.extra,0,i*sizeof(int));
} else
{
+ printf("loading file ...");
load_from_file(l_file,&d3_l,&my_info);
+ printf(" done\n");
if(convert)
{
if(!strcmp(c_file,"")) sprintf(c_file,"%s_gnuplot",l_file);
return 1;
}
#ifdef USE_DFB_API
- else d3_lattice_init(&argc,argv,&d3_l);
+ printf("d3 lattice init ...");
+ d3_lattice_init(&argc,argv,&d3_l);
+ printf(" done\n");
#endif
}
-#ifdef MORE_PRINTF
- printf(" done\n");
-#endif
-
#ifdef USE_DFB_API
+ printf("event init ...");
d3_event_init(&d3_l);
+ printf(" done\n");
#endif
#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(r_txt,"stress influence range: %d",my_info.range);
sprintf(stress_txt,"stress term: %f",my_info.s);
sprintf(ballistic_txt,"ballistic term: %f",my_info.b);
sprintf(carbon_txt,"carbon term: %f",my_info.c);
sprintf(diff_txt,"diffusion every %d steps",my_info.diff_rate);
strcpy(mode_txt,"view: a/c mode");
sprintf(hpi_txt,"hits per ion: %d",my_info.cpi);
- sprintf(csat_txt,"sputter rate (3nm/#c): %d",my_info.s_rate);
+ sprintf(srate_txt,"sputter rate (3nm/#c): %d",my_info.s_rate);
+ get_amorphous_layer_info(&d3_l,&sai,&sacl,&eacl);
+ sprintf(start_ai_txt,"start of a-inclusions: %d nm (%d)",3*sai,sai);
+ sprintf(start_acl_txt,"start of a-layer: %d nm (%d)",3*sacl,sacl);
+ sprintf(end_acl_txt,"end of a-layer: %d nm (%d)",3*eacl,eacl);
arg_v[1]=mode_txt;
arg_v[2]=xyz_txt;
arg_v[3]=status_txt;
arg_v[11]=dose_txt;
arg_v[12]=diff_txt;
arg_v[13]=zdiff_txt;
- arg_v[14]=r_txt;
+ arg_v[14]=dr_ac_txt;
arg_v[15]=ballistic_txt;
arg_v[16]=carbon_txt;
arg_v[17]=stress_txt;
- arg_v[18]=dr_ac_txt;
- arg_v[19]=dr_cc_txt;
- arg_v[20]=hpi_txt;
- arg_v[21]=csat_txt;
- arg_v[22]=NULL;
- arg_v[23]=NULL;
- arg_v[24]=NULL;
+ arg_v[18]=r_txt;
+ arg_v[19]=hpi_txt;
+ arg_v[20]=srate_txt;
+ arg_v[21]=NULL;
+ arg_v[22]=start_ai_txt;
+ arg_v[23]=start_acl_txt;
+ arg_v[24]=end_acl_txt;
arg_v[25]=NULL;
#endif
-#ifdef MORE_PRINTF
- printf("random rejection graphs ...");
-#endif
-
/* compute graphs for random number rejection method */
+ printf("random rejection graphs ...");
if((c_profile=(u32 *)malloc(d3_l.max_z*sizeof(unsigned int)))==NULL)
{
puts("failed allocating memory for carbon profile graph");
}
ip_max=get_reject_graph(&my_info,&d3_l,p_file,c_profile);
ne_max=get_reject_graph(&my_info,&d3_l,n_e_file,n_e_loss);
-
-#ifdef MORE_PRINTF
printf(" done\n");
-#endif
-
if((!strcmp(l_file,""))||(c_step))
{
if(c_profile[d3_l.max_z-1]!=0)
{
printf("max_z (%d) too small - sputtering not possible\n",d3_l.max_z);
- return -1;
+ do_sputter=0;
}
/* calculate ratio of c_simwindow / c_total */
- //if(get_c_ratio(&c_ratio,p_file,&my_info,&d3_l)!=1)
- //{
- // puts("failed calculating ratio");
- // return -1;
- //}
+ if(!do_sputter)
+ {
+ get_c_ratio(&c_ratio,p_file,&my_info,&d3_l);
+ printf("calculated c ratio: %f\n",c_ratio);
+ }
/* sputtering realy possible ?*/
if(n_e_loss[d3_l.max_z-1]!=0)
#endif
#ifdef DEBUG_NORM
printf("%d\n",get_rand(d3_l.max_z));
+#endif
+#ifdef DEBUG_LINEAR
+ printf("%d\n",get_rand_lgp(d3_l.max_z,1,0));
#endif
if(i==10000000) return 1;
i++;
#ifdef USE_DFB_API
if(i%refresh==0)
{
- sprintf(xyz_txt,"x: %d y: %d z: %d",x+1,y+1,z+1);
+ sprintf(xyz_txt,"x: %d y: %d z: %d (%d nm)",x+1,y+1,z+1,z*3);
sprintf(status_txt,"status: %c",(*(d3_l.status+x+y*d3_l.max_x+z*d3_l.max_x*d3_l.max_y)&AMORPH)?'a':'c');
- sprintf(conc_txt,"conc: %d",*(d3_l.extra+x+y*d3_l.max_x+z*d3_l.max_x*d3_l.max_y));
+ sprintf(conc_txt,"carbon: %d",*(d3_l.extra+x+y*d3_l.max_x+z*d3_l.max_x*d3_l.max_y));
sprintf(steps_txt,"step: %d",i);
sprintf(cc_txt,"total c: %d",my_info.cc);
+ get_amorphous_layer_info(&d3_l,&sai,&sacl,&eacl);
+ sprintf(start_ai_txt,"start of a-inclusions: %d nm (%d)",3*sai,sai);
+ sprintf(start_acl_txt,"start of a-layer: %d nm (%d)",3*sacl,sacl);
+ sprintf(end_acl_txt,"end of a-layer: %d nm (%d)",3*eacl,eacl);
d3_lattice_draw(&d3_l,x,y,z,25,arg_v,mode,0,NULL,0,NULL,0);
}
#endif
#endif
}
i++;
- if(i%my_info.s_rate==0) sputter(&d3_l);
+ if((do_sputter)&(i%my_info.s_rate==0)) sputter(&d3_l);
}
}
#ifdef USE_DFB_API
/* allocating buffer for pressure values */
+ printf("allocating buffer for preassure values ...");
if((d3_l.v_ptr=malloc(d3_l.max_x*d3_l.max_y*d3_l.max_z*sizeof(unsigned char)))==NULL)
{
puts("cannot allocate buffer for pressure values");
return -1;
}
+ printf(" done\n");
/* calc values */
+ printf("calculating preassure values ...");
calc_pressure(&d3_l,my_info.range);
+ printf(" done\n");
+ printf("finding maximum carbon concentration ...");
max_extra=calc_max_extra(&d3_l);
+ printf(" done\n");
while((quit==0) && (escape==0) && (nowait==0))
{
if(switchmode==2) mode=2;
if(switchmode==3) mode=3;
/* end of bahh! */
- sprintf(xyz_txt,"x: %d y: %d z: %d",x+1,y+1,z+1);
+ sprintf(xyz_txt,"x: %d y: %d z: %d (%d nm)",x+1,y+1,z+1,z*3);
sprintf(status_txt,"status: %c",(*(d3_l.status+x+y*d3_l.max_x+z*d3_l.max_x*d3_l.max_y)&AMORPH)?'a':'c');
- sprintf(conc_txt,"conc: %d",*(d3_l.extra+x+y*d3_l.max_x+z*d3_l.max_x*d3_l.max_y));
+ sprintf(conc_txt,"carbon: %d",*(d3_l.extra+x+y*d3_l.max_x+z*d3_l.max_x*d3_l.max_y));
sprintf(steps_txt,"step: end");
sprintf(cc_txt,"total c: %d",my_info.cc);
if(switchmode==0) strcpy(mode_txt,"view: a/c mode");
projects / physik / nlsop.git / blobdiff