In lattice mismatch alloys, the interface is under immense strain due to compression from lower lattice atoms and expansion or pull from atoms with higher lattice constant.

To study the strain profile for atoms around the interface, what tools/ software are available for computational studies?

Defect has formed under these conditions. Defect evolution is seen after molecular dynamics in a metallic alloy system. To study and have better understanding of the defect/ dislocation formation, what other factors can be evaluated for the system/atoms to show defect formation other than strain profile?

Similar questions and discussions