[Pw_forum] choosing oxygen and Hydrogen pseudopotentials

[Duy Le]

Go to this page, and choose the pps you want to use and download them.
http://www.quantum-espresso.org/pseudo.php
:)
<http://www.quantum-espresso.org/pseudo.php>
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Duy Le
PhD Student
Department of Physics
University of Central Florida.

"Men don't need hand to do things"


On Sat, Nov 7, 2009 at 1:48 AM, vamsi kv <vamsi.iisc at gmail.com> wrote:

> Dear all,
>
> I have done some work on metals using PWscf code.
> No i want to see how gases adsorb on metals. Inorder to do that i want to
> know how to choose pseudopotentials for gases say Oxygen and Hydrogen and
> how to tune the parameters of pseudopotentials to perform the calculations.
>
>
> K V Vamsi
>
>
>
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