#BeO MEAM potential #1->Be,2->O rc = 5.5 augt1 = 0 ialloy = 2 delr = 0.1 nn2(1,1)=1 nn2(1,2)=1 nn2(2,2)=1 #Be-O lattce(1,2)='hcp' Ec(1,2)= 4.190 # attrac(1,2)=0.005 # repuls(1,2)=0.005 alpha(1,2)= 5.80 re(1,2)= 1.742 Cmin(1,1,1) = 0.30 Cmax(1,1,1) = 2.80 Cmin(2,2,2) = 0.60 Cmax(2,2,2) = 2.80 Cmin(1,1,2) = 0.40 Cmax(1,1,2) = 0.82 Cmin(2,2,1) = 0.5 Cmax(2,2,1) = 2.26 Cmin(1,2,1) = 0.65 Cmax(1,2,1) = 1.80 Cmin(1,2,2) = 0.5 Cmax(1,2,2) = 2.8