Dear all,
we are looking for special POTCAR files:
(1) LDA-PAW POTCAR for Barium(Ba) with 6s-5p-5s-4d(20 electrons) in valence.
(2) LDA-USPP POTCAR for Zinc (Zn) with 4s2 (only 2 electrons) in valence.
(3) HSE-LDA POTCAR for Zinc (Zn) with 3d10-4s2 (12 electrons) in valence.
Are these files anywhere available ?
Best regards
Udo
missing POTCARs
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uschmidt
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missing POTCARs
Last edited by uschmidt on Fri Apr 26, 2013 10:46 am, edited 1 time in total.
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support_vasp
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Re: missing POTCARs
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.
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VASP