[gpaw-users] : RuntimeError: Ghost!

Ask Hjorth Larsen askhl at fysik.dtu.dk
Sat Nov 13 22:16:00 CET 2010


Hi Yuelin

On Sat, 13 Nov 2010, Yuelin Li wrote:

> Hi Ask,
> 
> Thanks. I will read the paper to understand the issue. On the other hand, I
> wonder if you have a quick fix for the current script, i.e., the "some other
> parameters" that can be used. Thanks,
> 
> Best,
> 
> Yuelin

Unfortunately the best advice I can give is to look at the setups of 
elements with similar electron configurations.  It's non-trivial to 
generate pseudopotentials and PAW setups.  I don't know whether the 
article really provides any solutions, but it does explain what the issue 
is.

Regards
Ask


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