Unverified Commit 5a94d66b authored by oekosheri's avatar oekosheri Committed by GitHub
Browse files

Update README.md

parent 8707fc24
Loading
Loading
Loading
Loading
+2 −1
Original line number Diff line number Diff line
@@ -158,7 +158,8 @@ The 0K miminimization is composed of: A congugate gradient minimization of the e
similar to a procedure explained [here](https://icme.hpc.msstate.edu/mediawiki/index.php/LAMMPS_Input_Deck_for_Grain_boundary_generation).
For the annealing simulations I use an _nvt_ ensemble followed by damped dynamics. Depending on the GB structure and your final purpose you can run annealing simulations for different time spans.


# License
[MIT](./LICENSE).