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) = 4.4500 re(2,2) = 2.4900 alpha(2,2) = 5.08421758 repuls(2,2) = 0.0500 attrac(2,2) = 0.0500 Cmin(2,2,2) = 0.8100 Cmax(2,2,2) = 2.8000 zbl(1,2) = 0 nn2(1,2) = 1 lattce(1,2) = 'b2' Ec(1,2) = 4.5307 re(1,2) = 2.4916 alpha(1,2) = 4.82953835 repuls(1,2) = 0.0500 attrac(1,2) = 0.0500 Cmin(1,1,2) = 0.4900 Cmin(2,2,1) = 1.6000 Cmin(1,2,1) = 0.6400 Cmin(2,1,1) = 0.6400 Cmin(1,2,2) = 0.6400 Cmin(2,1,2) = 0.6400 Cmax(1,1,2) = 2.8000 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