I want to simulate a axial tension of Al/Ni film under a constant temperature. I don’t know if Lammps can solve it. So I ask for your help.
I have used the commands like “displace_box”,“displace_atoms”.But, It is always not in the correct way. I don’t know why. And I don’t know which ensemble can fit for this system. I have chose the NVT ensemble and NPT ensemble. I don’t know if that is correct.
I am waiting for your reply.
Thanks a lot.
Try using the “fix deform” command along with an NVT ensemble.
2009/8/22 delizheng <[email protected]…223…>