started potentials

[physik/posic.git] / posic.h

diff --git a/posic.h b/posic.h
index a26e66830e1cfc2e10b17f3e275ae6c63f87d0da..8f306ec913bd7c9225b8eff72384e6669c44f5ff 100644 (file)
--- a/posic.h
+++ b/posic.h
@@ -20,6 +20,8 @@
 #define RUNS 15000
 #define TAU 0.001
 
+#define TEMPERATURE 273.0 
+
 #define SI_M 1
 #define SI_LC 5.43105
 #define LJ_SIGMA SI_LC
@@ -27,9 +29,9 @@
 #define LJ_SIGMA_06 (LJ_SIGMA_02*LJ_SIGMA_02*LJ_SIGMA_02)
 #define LJ_SIGMA_12 (LJ_SIGMA_06*LJ_SIGMA_06)
 
-#define LEN_X 2
-#define LEN_Y 2
-#define LEN_Z 2
+#define LEN_X 1
+#define LEN_Y 1
+#define LEN_Z 1
 
 #define R_CUTOFF 20
 #define R2_CUTOFF (R_CUTOFF*R_CUTOFF)