rc = 4.5 delr = 0.1 augt1 = 0 erose_form = 2 ialloy = 2 zbl(1,1) = 0 nn2(1,1) = 1 attrac(1,1) = 0.05 repuls(1,1) = 0.05 Cmin(1,1,1) = 1.69 Cmax(1,1,1) = 2.8 Ec(1,1) = 3.91 re(1,1) = 2.75 zbl(2,2) = 0 nn2(2,2) = 1 attrac(2,2) = 0.05 repuls(2,2) = 0.05 Cmin(2,2,2) = 0.36 Cmax(2,2,2) = 2.8 Ec(2,2) = 4.29 re(2,2) = 2.48 zbl(1,2) = 0 nn2(1,2) = 1 rho0(1) = 1 rho0(2) = 1 Ec(1,2) = 4.095 re(1,2) = 2.72 alpha(1,2) = 5.87962853471044 attrac(1,2) = 0.05 repuls(1,2) = 0.05 Cmin(1,1,2) = 1.69 Cmin(2,2,1) = 0.01 Cmin(1,2,1) = 1.8 Cmin(1,2,2) = 2 Cmin(2,1,1) = 1.8 Cmin(2,1,2) = 2 Cmax(1,1,2) = 2.8 Cmax(2,2,1) = 1.44 Cmax(1,2,1) = 2.8 Cmax(1,2,2) = 2.8 Cmax(2,1,1) = 2.8 Cmax(2,1,2) = 2.8 lattce(1,2) = 'l12'