Integrated Computational Materials Engineering (ICME)

AlMg.meam

This is one of the potential files. This defines parameters relevant to interactions between Aluminum and Magnesium atoms. Copy and paste the text in to a file named AlMg.meam

 lattce(1,2)='b1'
 delta(1,2)=0.4575
 alpha(1,2)=4.915
 re(1,2)=2.821
 rho0(1)=1.0
 rho0(2)=0.6
 rc=5.0
 Cmin(1,1,2) = 0.00
 Cmin(2,2,1) = 2.00
 Cmin(1,2,1) = 2.00
 Cmin(1,2,2) = 2.00
 ialloy=1
 nn2(1,1)=1
 nn2(2,2)=1