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 repuls(1,1) = 0 Cmin(1,1,1) = 1 Cmax(1,1,1) = 1.44 Ec(1,1) = 6.36 re(1,1) = 3.2 zbl(2,2) = 0 nn2(2,2) = 0 attrac(2,2) = 0 repuls(2,2) = 0 Cmin(2,2,2) = 2 Cmax(2,2,2) = 2.8 Ec(2,2) = 2.37 re(2,2) = 0.71 zbl(1,2) = 0 nn2(1,2) = 1 rho0(1) = 1 rho0(2) = 16 Ec(1,2) = 4.215 re(1,2) = 1.85 alpha(1,2) = 3.50371789153897 attrac(1,2) = 0 repuls(1,2) = 0 Cmin(1,1,2) = 0.5 Cmin(2,2,1) = 2 Cmin(1,2,1) = 2 Cmin(1,2,2) = 0.09 Cmin(2,1,1) = 2 Cmin(2,1,2) = 0.09 Cmax(1,1,2) = 2.15 Cmax(2,2,1) = 2.8 Cmax(1,2,1) = 2.8 Cmax(1,2,2) = 1.44 Cmax(2,1,1) = 2.8 Cmax(2,1,2) = 1.44 lattce(1,2) = 'dia'