[Wien] Engel and Vosko GGA approximation ?
Peter Blaha
pblaha at theochem.tuwien.ac.at
Thu Feb 23 14:54:29 CET 2006
Yes. It can be used by changing case.in0 from 13 to 25.
Be aware of the limitations of this GGA !!!
> Dear Prof Dr Blaha
>
> the Engel and Vosko GGA approximation is implemented in the Wien2k code ?
>
> Thank's for your help
>
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P.Blaha
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Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-1-58801-15671 FAX: +43-1-58801-15698
Email: blaha at theochem.tuwien.ac.at WWW: http://info.tuwien.ac.at/theochem/
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