potentials/harmonic_oscillator.h

   1 /*
   2  * harmonic_oscillator.h - harmonic oscillator potential header file
   3  *
   4  * author: Frank Zirkelbach <frank.zirkelbach@physik.uni-augsburg.de>
   5  *
   6  */
   7
   8 #ifndef HARMONIC_OSCILLATOR_H
   9 #define HARMONIC_OSCILLATOR_H
  10
  11 /* types */
  12 typedef struct s_ho_params {
  13         double spring_constant;
  14         double equilibrium_distance;
  15 } t_ho_params;
  16
  17 /* function prototype */
  18 int harmonic_oscillator(t_moldyn *moldyn,t_atom *ai,t_atom *aj,u8 bc);
  19
  20 #endif