rc = 4.5 delr = 0.1 augt1 = 0 erose_form = 2 ialloy = 2 zbl(1,1) = 0 nn2(1,1) = 1 attrac(1,1) = 0.02 repuls(1,1) = 0.1 Cmin(1,1,1) = 0.71 Cmax(1,1,1) = 2.8 Ec(1,1) = 4.1 re(1,1) = 2.495 zbl(2,2) = 0 nn2(2,2) = 1 attrac(2,2) = 0 repuls(2,2) = 0 Cmin(2,2,2) = 0.16 Cmax(2,2,2) = 2.8 Ec(2,2) = 2.9 re(2,2) = 2.53 zbl(1,2) = 0 nn2(1,2) = 1 rho0(1) = 1 rho0(2) = 1 Ec(1,2) = 3.525 re(1,2) = 2.5125 alpha(1,2) = 5.63386454033266 attrac(1,2) = 0.01 repuls(1,2) = 0.05 Cmin(1,1,2) = 0.64 Cmin(2,2,1) = 1 Cmin(1,2,1) = 0.81 Cmin(1,2,2) = 0.81 Cmin(2,1,1) = 0.81 Cmin(2,1,2) = 0.81 Cmax(1,1,2) = 2.8 Cmax(2,2,1) = 2.8 Cmax(1,2,1) = 1.44 Cmax(1,2,2) = 2.8 Cmax(2,1,1) = 1.44 Cmax(2,1,2) = 2.8 lattce(1,2) = 'b2'