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Dear all,<br>
<br>
I am going to do something with the surface phonons of metals,
especially for a surface with an absorbate. But I have no idea how can
I fulfil this.<br>
I have read and tried the example02, but I am not sure if I should do the s=
ame way as it?<br>
For a surface simulated by a slab supercell, there would be two
surfaces, actually, how can I mimic the bulk like substrate? By
including thicker slab or just fixed one side as is done in a surface
relaxation? <br>
<br>
If anyone can share the script to do so, it will be highly appreciate.<br>
<br>
Thank you.<br>
<br>
Konzern<br>
<br>