u8 pbcz;
int element1; // element 1
- double m1;
int element2; // element 2
- double m2;
double lc; // lattice constant
u8 lattice; // type of lattice
} t_insert_mixed_atoms_params;
#define INS_TOTAL 0x01
-#define INS_REGION 0x02
-#define INS_POS 0x03
+#define INS_RECT 0x02
+#define INS_SPHERE 0x03
+#define INS_POS 0x04
typedef struct s_continue_params {
int runs;
u8 lattice;
int fill_element;
u8 fill_brand;
- u8 p_type;
- t_part_vals p_vals;
+ t_part_params p_params;
+ t_defect_params d_params;
} t_fill_params;
/*