rc = 5.0 delr = 0.1 augt1 = 0 erose_form = 2 ialloy = 2 zbl(1,1) = 0 nn2(1,1) = 1 attrac(1,1) = 0.0500 repuls(1,1) = 0.0500 Cmin(1,1,1) = 0.8 Cmax(1,1,1) = 2.8 Ec(1,1) = 3.54 re(1,1) = 2.5562 zbl(2,2) = 0 nn2(2,2) = 1 attrac(2,2) = -0.16 repuls(2,2) = -0.16 Cmin(2,2,2) = 0.8 Cmax(2,2,2) = 2.8 Ec(2,2) = 7.37 re(2,2) = 1.54456 rho0(1) = 1 rho0(2) = 6.80 zbl(1,2) = 0 nn2(1,2) = 1 Ec(1,2) = 3.735 re(1,2) = 2.06393 alpha(1,2) =5.015 attrac(1,2) = -0.13 repuls(1,2) = -0.13 Cmin(1,1,2) = 1.0 Cmin(2,2,1) = 1.25 Cmin(1,2,1) = 1.0 Cmin(1,2,2) = 1.35 Cmin(2,1,1) = 1.0 Cmin(2,1,2) = 1.35 Cmax(1,1,2) = 2.10 Cmax(2,2,1) = 2.35 Cmax(1,2,1) = 2.65 Cmax(1,2,2) = 2.40 Cmax(2,1,1) = 2.65 Cmax(2,1,2) = 2.40 lattce(1,2) = 'b1'