Dear VASPers,
I am wondering if we by somehow can put an ion (let's say: Na+) into a supercell? One way I know is to use NELECT.
Thanks!
<span class='smallblacktext'>[ Edited ]</span>
Charged Defects
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Charged Defects
Last edited by user on Wed Feb 22, 2006 7:45 pm, edited 1 time in total.