insert mixed atoms feature added (will be renamed an cleand up later)
[physik/posic.git] / moldyn.h
index cd7c5d0..11fdf6b 100644 (file)
--- a/moldyn.h
+++ b/moldyn.h
@@ -352,6 +352,13 @@ typedef struct s_vb {
 #define FCC                    0x02
 #define DIAMOND                        0x04
 #define ZINCBLENDE             0x08
+#define NONE                   0x80
+
+/*
+ * more includes
+ */
+
+#include "pse.h"
 
 /*
  *