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Having a question about the PAW potential

Posted: Mon Oct 27, 2008 1:00 am
by MDrizzle
Dear Sir or Madam,

I need a help. I want to understand the scalar relativistic effects included in the PAW potential. For example, we consider the Au potential. By charging it with an extra electron to the Au atom, could the PAW potential deal with the extra electron with the scalar relativistic effects?

I would appreciate greatly for your kind help!

MDrizzle

Re: Having a question about the PAW potential

Posted: Wed Sep 11, 2024 1:48 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