The fix deform command can change the shape/size of your
simulation box, similar to how stress/strain tests are done
with expts. You typically just use fix nve to integrate the
atoms while fix deform is doing its thing.
Steve
The fix deform command can change the shape/size of your
simulation box, similar to how stress/strain tests are done
with expts. You typically just use fix nve to integrate the
atoms while fix deform is doing its thing.
Steve