Relax first layer of atoms only
Posted: Wed Jan 24, 2007 11:43 am
Hi,
In surface calculations, how & where do I set my parameters so as to relax only the first layer of atoms, keeping the layers below frozen?
Thanks for any help on this!
S
In surface calculations, how & where do I set my parameters so as to relax only the first layer of atoms, keeping the layers below frozen?
Thanks for any help on this!
S