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Charged Defects

Posted: Wed Feb 22, 2006 7:45 pm
by user
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>

Re: Charged Defects

Posted: Wed Sep 11, 2024 1:27 pm
by support_vasp

Hi,

We're sorry that we didn’t answer your question. This does not live up to the quality of support that we aim to provide. The team has since expanded. If we can still help with your problem, please ask again in a new post, linking to this one, and we will answer as quickly as possible.

Best wishes,

VASP