added (sample) configuration file

diff --git a/config.h b/config.h
new file mode 100644 (file)
index 0000000..8783dc6
--- /dev/null
+++ b/config.h
@@ -0,0 +1,64 @@
+/*
+ * configuration file
+ *
+ */
+
+// simulation volume
+
+#define LCNTX          31
+#define LCNTY          31
+#define LCNTZ          31
+
+// prerun
+
+#define PRERUN         600
+#define PRE_TAU                1.0
+
+// insertrun
+
+#define INS_RUNS       620
+#define INS_ATOMS      10
+
+#define INS_CARBON     /* comment for silicon */
+
+#ifdef INS_CARBON
+ #define INS_TYPE      C
+ #define INS_MASS      M_C
+ #define INS_BRAND     1
+#else
+ #define INS_TYPE      SI
+ #define INS_MASS      M_SI
+ #define INS_BRAND     0
+#endif
+
+//#define INS_LENX     (1*ALBE_LC_SIC)
+//#define INS_LENY     (1*ALBE_LC_SIC)
+//#define INS_LENZ     (1*ALBE_LC_SIC)
+#define INS_LENX       (31*ALBE_LC_SI)
+#define INS_LENY       (31*ALBE_LC_SI)
+#define INS_LENZ       (31*ALBE_LC_SI)
+#define INS_OFFSET     (ALBE_LC_SI/8.0)
+
+#define INS_R_C                1.5
+#define INS_DELTA_TC   1.0
+#define INS_RELAX      10
+#define INS_TAU                1.0
+
+// postrun
+
+#define POST_RUNS      430
+#define POST_DELTA_TC  1.0
+#define POST_DT                1.0
+#define POST_RELAX     10
+#define POST_TAU       1.0
+
+// log
+
+#define R_TITLE                "Carbon into silicon"
+#define LOG_E          10
+#define LOG_T          10
+#define LOG_P          10
+#define LOG_S          200
+#define LOG_V          200
+
+#define AVG_SKIP       500