rc = 4.8 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) = 1.53 Cmax(1,1,1) = 2.8 Ec(1,1) = 5.77 re(1,1) = 2.77 zbl(2,2) = 0 nn2(2,2) = 1 attrac(2,2) = 0 repuls(2,2) = 0 Cmin(2,2,2) = 1 Cmax(2,2,2) = 1.44 Ec(2,2) = 4.87 re(2,2) = 2.92 zbl(1,2) = 0 nn2(1,2) = 1 rho0(1) = 1 rho0(2) = 1 Ec(1,2) = 6.245 re(1,2) = 2.754 alpha(1,2) = 5.43429078220985 attrac(1,2) = 0.025 repuls(1,2) = 0.025 Cmin(1,1,2) = 0.5 Cmin(2,2,1) = 0.9 Cmin(1,2,1) = 1.25 Cmin(1,2,2) = 1.25 Cmin(2,1,1) = 1.25 Cmin(2,1,2) = 1.25 Cmax(1,1,2) = 1.44 Cmax(2,2,1) = 2 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) = 'b2'