| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/nwpwlib/pseudopotential/ |
| H A D | carter_parse.c | 70 double rlocal_out; local
116 rlocal_out = *rlocal_ptr;
218 fprintf(fp,"%lf %lf %d %d %d %lf\n",zion,0.0,lmax,lmax_out,locp,rlocal_out);
251 printf(" rlocal= %lf\n\n",rlocal_out);
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| H A D | qmmm_parse.c | 71 double rlocal_out; local
112 rlocal_out = *rlocal_ptr;
256 fprintf(fp,"%lf %lf %d %d %d %lf\n",Zion,0.0,lmax,lmax_out,locp_out,rlocal_out);
293 printf(" rlocal: %lf\n\n",rlocal_out);
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| H A D | teter_parse.c | 74 double rlocal_out; local
120 rlocal_out = *rlocal_ptr;
358 fprintf(fp,"%lf %lf %d %d %d %lf\n",zion,0.0,lmax,lmax_out,locp,rlocal_out);
416 printf(" rlocal= %lf\n\n",rlocal_out);
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| H A D | cpi_parse.c | 73 double rlocal_out; local
118 rlocal_out = *rlocal_ptr;
359 fprintf(fp,"%lf %lf %d %d %d %lf\n",Zion,0.0,lmax,lmax_out,locp_out,rlocal_out);
415 printf(" rlocal: %lf\n\n",rlocal_out);
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| H A D | rpspsolve.c | 74 double rlocal_out, vx; local
91 rlocal_out = *rlocal_ptr;
229 lmax_RelPsp (), lmax_out, locp_out, rlocal_out);
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| H A D | hgh_parse.c | 63 double rlocal_out; local
102 rlocal_out = *rlocal_ptr;
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| H A D | pspsolve.c | 83 double rlocal_out,rmax; local
100 rlocal_out = *rlocal_ptr;
281 lmax_Psp(), lmax_out, locp_out, rlocal_out);
|
| /dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/nwpwlib/pseudopotential/ |
| H A D | carter_parse.c | 70 double rlocal_out; local
116 rlocal_out = *rlocal_ptr;
218 fprintf(fp,"%lf %lf %d %d %d %lf\n",zion,0.0,lmax,lmax_out,locp,rlocal_out);
251 printf(" rlocal= %lf\n\n",rlocal_out);
|
| H A D | qmmm_parse.c | 71 double rlocal_out; local
112 rlocal_out = *rlocal_ptr;
256 fprintf(fp,"%lf %lf %d %d %d %lf\n",Zion,0.0,lmax,lmax_out,locp_out,rlocal_out);
293 printf(" rlocal: %lf\n\n",rlocal_out);
|
| H A D | teter_parse.c | 74 double rlocal_out; local
120 rlocal_out = *rlocal_ptr;
358 fprintf(fp,"%lf %lf %d %d %d %lf\n",zion,0.0,lmax,lmax_out,locp,rlocal_out);
416 printf(" rlocal= %lf\n\n",rlocal_out);
|
| H A D | cpi_parse.c | 73 double rlocal_out; local
118 rlocal_out = *rlocal_ptr;
359 fprintf(fp,"%lf %lf %d %d %d %lf\n",Zion,0.0,lmax,lmax_out,locp_out,rlocal_out);
415 printf(" rlocal: %lf\n\n",rlocal_out);
|
| H A D | rpspsolve.c | 74 double rlocal_out, vx; local
91 rlocal_out = *rlocal_ptr;
229 lmax_RelPsp (), lmax_out, locp_out, rlocal_out);
|
| H A D | hgh_parse.c | 63 double rlocal_out; local
102 rlocal_out = *rlocal_ptr;
|
| H A D | pspsolve.c | 83 double rlocal_out,rmax; local
100 rlocal_out = *rlocal_ptr;
281 lmax_Psp(), lmax_out, locp_out, rlocal_out);
|
| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/nwpwlib/pseudopotential/paw_atom/ |
| H A D | paw_atom_driver.c | 76 double rlocal_out; local
122 rlocal_out = *rlocal_ptr;
|
| /dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/nwpwlib/pseudopotential/paw_atom/ |
| H A D | paw_atom_driver.c | 76 double rlocal_out; local
122 rlocal_out = *rlocal_ptr;
|