rc = 4.8 delr = 0.1 augt1 = 0 erose_form = 2 ialloy = 2 zbl(1,1) = 0 nn2(1,1) = 1 rho0(1) = 1.0000 Ec(1,1) = 3.3600 re(1,1) = 2.8600 alpha(1,1) = 4.68559768 repuls(1,1) = 0.0500 attrac(1,1) = 0.0500 Cmin(1,1,1) = 0.4900 Cmax(1,1,1) = 2.8000 zbl(2,2) = 0 nn2(2,2) = 1 rho0(2) = 1.0000 Ec(2,2) = 4.8700 re(2,2) = 2.9200 alpha(2,2) = 4.71945663 repuls(2,2) = 0.0000 attrac(2,2) = 0.0000 Cmin(2,2,2) = 1.0000 Cmax(2,2,2) = 1.4400 zbl(1,2) = 0 nn2(1,2) = 1 lattce(1,2) = 'b2' Ec(1,2) = 4.3750 re(1,2) = 2.8000 alpha(1,2) = 5.56259868 repuls(1,2) = 0.0250 attrac(1,2) = 0.0250 Cmin(1,1,2) = 0.4900 Cmin(2,2,1) = 1.3000 Cmin(1,2,1) = 0.7225 Cmin(2,1,1) = 0.7225 Cmin(1,2,2) = 0.4600 Cmin(2,1,2) = 0.4600 Cmax(1,1,2) = 1.4400 Cmax(2,2,1) = 2.8000 Cmax(1,2,1) = 2.8000 Cmax(2,1,1) = 2.8000 Cmax(1,2,2) = 1.4400 Cmax(2,1,2) = 1.4400