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 #ifdef PSE_MASS
  11 static double pse_mass[]={
  12         0,
  13         0,
  14         0,
  15         0,
  16         0,
  17         0,
  18         M_C,
  19         0,
  20         0,
  21         0,
  22         0,
  23         0,
  24         0,
  25         0,
  26         M_SI,
  27         0,
  28         0,
  29         0,
  30         0,
  31 };
  32 #endif
  33
  34 #ifdef PSE_LC
  35 static double pse_lc[]={
  36         0,
  37         0,
  38         0,
  39         0,
  40         0,
  41         0,
  42         LC_C,
  43         0,
  44         0,
  45         0,
  46         0,
  47         0,
  48         0,
  49         0,
  50         LC_SI,
  51         0,
  52         0,
  53         0,
  54         0,
  55 };
  56 #endif
  57
  58 #ifdef PSE_NAME
  59 static char *pse_name[]={
  60         "*",
  61         "H",
  62         "He",
  63         "Li",
  64         "Be",
  65         "B",
  66         "C",
  67         "N",
  68         "O",
  69         "F",
  70         "Ne",
  71         "Na",
  72         "Mg",
  73         "Al",
  74         "Si",
  75         "P",
  76         "S",
  77         "Cl",
  78         "Ar",
  79 };
  80 #endif
  81
  82 #ifdef PSE_COL
  83 static char *pse_col[]={
  84         "*",
  85         "White",
  86         "He",
  87         "Li",
  88         "Be",
  89         "B",
  90         "Gray",
  91         "N",
  92         "Blue",
  93         "F",
  94         "Ne",
  95         "Na",
  96         "Mg",
  97         "Al",
  98         "Yellow",
  99         "P",
 100         "S",
 101         "Cl",
 102         "Ar",
 103 };
 104 #endif
 105