[Pw_forum] PAW potential for C

Duy Le ttduyle at gmail.com
Thu Nov 10 00:04:14 CET 2011


On Wed, Nov 9, 2011 at 5:55 PM, chengyu yang <chengyu.young at gmail.com>wrote:

> explain my other two questions, like: if the choice of potential and k
> point change the final binding energy of two systems.  Thank you.
>           Best regards.
>
>
The best way to answer these two questions is to test them. The tests are
very simple and easy to perform:

1. Use different potential to calculate the quantity in question.

2. Use different k-point set to calculate the quantity in question.

--------------------------------------------------
Duy Le
PhD Candidate
Department of Physics
University of Central Florida.

"Men don't need hand to do things"
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