lammps-users Digest, Vol 100, Issue 9

Dear Axel

Thanks for your reply. What I want is, the strain profile . To see how each atom is displaced in all directions (Axial and shear strain components).

Regards,
Z

first off, it is considered bad mailing list manners to not adjust the
subject line when replying to a digested e-mail and also you should
delete all the irrelevant parts of the digest, i.e. whatever you are
not replying to. replying the way you do makes it confusing, since
nobody knows anymore what the discussion is about and you send a lot
of stuff around that nobody wants to see (again).

thanks.

Dear Axel

Thanks for your reply. What I want is, the strain profile . To see how
each atom is displaced in all directions (Axial and shear strain
components).

how about using fix store/state and then an atom style variable?

or write a little script/program that compares two frames of a trajectory dump?

axel.