pse.h

   1 /*
   2  * pse.h - elemnts specific stuff
   3  *
   4  * author: Frank Zirkelbach <frank.zirkelbach@physik.uni-augsburg.de>
   5  *
   6  */
   7
   8 #include "moldyn.h"
   9
  10 static double pse_mass[]={
  11         0,
  12         0,
  13         0,
  14         0,
  15         0,
  16         0,
  17         M_C,
  18         0,
  19         0,
  20         0,
  21         0,
  22         0,
  23         0,
  24         0,
  25         M_SI,
  26         0,
  27         0,
  28         0,
  29         0,
  30 };
  31
  32 static double pse_lc[]={
  33         0,
  34         0,
  35         0,
  36         0,
  37         0,
  38         0,
  39         LC_C,
  40         0,
  41         0,
  42         0,
  43         0,
  44         0,
  45         0,
  46         0,
  47         LC_SI,
  48         0,
  49         0,
  50         0,
  51         0,
  52 };
  53
  54 static char *pse_name[]={
  55         "*",
  56         "H",
  57         "He",
  58         "Li",
  59         "Be",
  60         "B",
  61         "C",
  62         "N",
  63         "O",
  64         "F",
  65         "Ne",
  66         "Na",
  67         "Mg",
  68         "Al",
  69         "Si",
  70         "P",
  71         "S",
  72         "Cl",
  73         "Ar",
  74 };
  75
  76 static char *pse_col[]={
  77         "*",
  78         "White",
  79         "He",
  80         "Li",
  81         "Be",
  82         "B",
  83         "Gray",
  84         "N",
  85         "Blue",
  86         "F",
  87         "Ne",
  88         "Na",
  89         "Mg",
  90         "Al",
  91         "Yellow",
  92         "P",
  93         "S",
  94         "Cl",
  95         "Ar",
  96 };
  97