/*
* posic.h - precipitation process of silicon carbide in silicon
*
- * author: Frank Zirkelbach <hackbard@hackdaworl.org>
+ * author: Frank Zirkelbach <frank.zirkelbach@physik.uni-augsburg.de>
*
*/
+#ifndef POSIC_H
+#define POSIC_H
+
+/* includes */
+
#define _GNU_SOURCE
+
+// system
#include <stdio.h>
#include <stdlib.h>
#include <string.h>
#include <sys/stat.h>
#include <fcntl.h>
-#ifndef POSIC_H
-#define POSIC_H
+#include <math.h>
-#define RUNS 10000000
-#define TAU 0.000000000000001
-#define WRITE_FILE 100000
+// swapped out functions
+#include "math/math.h"
+#include "list/list.h"
+#include "random/random.h"
-#define TEMPERATURE 273.0
+// moldyn core functions
+#include "moldyn.h"
-#define LEN_X 3
-#define LEN_Y 3
-#define LEN_Z 3
+// potentials
+#include "potentials/harmonic_oscillator.h"
+#include "potentials/lennard_jones.h"
+#include "potentials/albe.h"
+#ifdef TERSOFF_ORIG
+#include "potentials/tersoff_orig.h" // obsolete & wrong! ;)
+#else
+#include "potentials/tersoff.h"
+#endif
-#define R_CUTOFF (0.25*LEN_Z)
+/* defines */
#endif