[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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