Dear all:<div> It's ok that I used the surface dipole correction when geometric optimization for pure ceria (1 1 1) surface, however, there is an error when I put a single atom Pd on the surface.</div><div> <img alt="1.png" width="550px" height="135px" data-atf="true" src="cid:3d7a5011-3a5c-45c6-b021-1cd4fc1ab814"></div><div>Any help would be very much appreciated!!!</div><div><br></div>
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