[Pw_forum] Does any one have Gd and Ce Pseudopotentials???

[Prithwish Nandi]

 Hi Stefano,
 Its really nice to hear from you. I am also 
interested in doped cerium-oxide and I want to 
do some spin polarized calculations.You have not specified whether your PP is LDA/GGA. Anyway, hope 
the PP will serve my purpose very well. Looking forward. Thanks a lot.

 With regards.

 Prithwish Nandi
 Research Scholar.
 IGCAR, Kalpakkam, India






Quoting  fabris at democritos.it:

> Dear Prithwish,

during next week, I will add to the pseudopotential library (http:// 
www.pwscf.org/pseudo.htm) the Ce pseudopotential we used to study  
cerium-oxide. As you know, in general, compounds based on rare earths  
may display quite intriguing properties and our pseudo has not been  
tested for systems other than cerias. You can refer to me if you have  
specific questions, I will be happy to contribute as far as I can.

Yours sincerely,
				Stefano

On 5 Apr , 2007, at 11:25 , Prithwish Nandi wrote:

>
>   Hi,
>    Does anyone has the pseudo potentials for Gd and
>    Ce
> ?
>
>   With regards.
>
>   Prithwish Nandi
>   Research Scholar
>
> IGCAR, Kalpakkam, India
>
>

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