Lattice.h

   1 #ifndef _LATTICE_H
   2 #define _LATTICE_H
   3
   4 #include <blitz/array.h>
   5 using namespace blitz;
   6
   7 enum Occupation {
   8         empty = 0,
   9         CO,
  10         Pd
  11 };
  12
  13 typedef Array<Occupation, 2> LatticeType;
  14
  15 class Lattice {
  16 public:
  17         Lattice();
  18         Lattice(int, int, int, int);
  19
  20         LatticeType adsorbates;
  21         LatticeType surface;
  22         int Latitude, Longitude;
  23         int UnitCellSizeX, UnitCellSizeY;
  24
  25         void extendUnitCell(void);
  26
  27 private:
  28         void extendUnitCell(LatticeType, int, int);
  29
  30 };
  31
  32 #endif