[CPMD-list] Pt basis set

[Axel Kohlmeyer]

On Thu, 24 May 2007, Leandro Moreira de Campos Pinto wrote:

LM> Dear CPMD users,
LM> 

leandro,

LM> could anybody send me the basis set for Platinum??

the basis set in CPMD is not element specific (plane waves)
and is solely determined by the plane wave energy cutoff
(which has to be adjusted to the hardness of the pseudodpotentials
that you are using).

do you mean you are looking for a pseudopotential for platinum?

cheers,
   axel.

LM> 
LM> Best regards.
LM> 
LM> Leandro
LM> 
LM> 

-- 
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Axel Kohlmeyer   akohlmey at cmm.chem.upenn.edu   http://www.cmm.upenn.edu
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