#define MOLDYN_H
#include "math/math.h"
+#include "random/random.h"
/* datatypes */
/* defines */
+#define K_BOLTZMANN 1.3807E-23
+
#define FCC 0x01
#define DIAMOND 0x02
int create_lattice(unsigned char type,int element,double mass,double lc,
int a,int b,int c,t_atom **atom);
+int destroy_lattice(t_atom *atom);
+int thermal_init(t_atom *atom,t_random *random,int count,double t);
+int scale_velocity(t_atom *atom,int count,double t);
+double get_e_kin(t_atom *atom,int count);
#endif