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Why HGH PsP only has several lines?  [SOLVED]

Posted: Wed Nov 27, 2013 3:22 am
by ljludwig
Since it deals with Spin-Orbit coupling, I was expecting a more complicated pseudopotential than the LDA-TM one,

However, the HGH pseudo-potentials have only a few lines. Am I missing anything?

What's more, for calculation of spin-orbit coupling in LDA, can I simply use LDA-TM? Or hgh is a requirement?

Many thanks!

Re: Why HGH PsP only has several lines?

Posted: Wed Nov 27, 2013 3:49 am
by ljludwig
Well when I saw the original paper and see it is analytical form then I came to realize how it works.

Still there is one thing I am confused, that in a S-O coupling calculation, is hgh potential the only choice?