rc = 5.5000000 delr = 0.1 augt1 = 0 erose_form = 2 ialloy = 2 zbl(1,1) = 0 nn2(1,1) = 1 attrac(1,1) = 0.000 repuls(1,1) = 0.000 Cmin(1,1,1) = 0.81000 Cmax(1,1,1) = 2.8 Ec(1,1) = 2.04 re(1,1) = 3.5 zbl(2,2) = 0 nn2(2,2) = 0 attrac(2,2) = 0 repuls(2,2) = 0 Cmin(2,2,2) = 0.8 Cmax(2,2,2) = 2.8 Ec(2,2) = 3.08 re(2,2) = 3.436538957 zbl(2,2) = 0 nn2(1,2) = 1 rho0(1) = 1 rho0(2) = 1 Ec(1,2) = 2.56 re(1,2) = 3.3 alpha(1,2) = 6.2913 attrac(1,2) = 0.0 repuls(1,2) = 0.0 Cmin(1,1,2) = 1.304992236 Cmin(2,2,1) = 0.504992236 Cmin(1,2,1) = 0.3 Cmin(1,2,2) = 0.3 Cmin(2,1,1) = 0.51 Cmin(2,1,2)= 0.51 Cmax(1,1,2) = 2.80000 Cmax(2,2,1) = 2.80000 Cmax(1,2,1) = 2.80000 Cmax(1,2,2) = 2.80000 Cmax(2,1,1) = 2.8 Cmax(2,1,2) = 2.80000 lattce(1,2) = 'b2'