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["Bartosz Slomski" <bartek1982@gmx.de>]

sorry, but i already fixed that problem. of course i have to find proper 
pseudopot. files for lead :)

but still i want to know something about simulating bandstructure with SOC.

thanks
-------- Original-Nachricht --------
> Datum: Sun, 26 Jul 2009 21:31:13 +0200
> Von: "Bartosz Slomski" <bartek1982@gmx.de>
> An: forum@abinit.org
> Betreff: [abinit-forum] Calculating Bandstructure of Pb

> Hello,
> 
> i am very new to abinit. because i am actually mostly interested in
> simulating bandstructure i started 
> with lesson 3, calculating the bandstructure of silicon.
> so far, everything went fine. now, i wanted to check whether i could also
> calculate the bandstructure 
> of lead. i only changed some input parameter of the t35.in file. 
> running t3x.files was okay, but the data were very similar to that of
> silicon. 
> i noticed that by running t3x.files the code takes data from
> /psps_for_tests/14si.pspnc to calculate
> the bandstructure. 
> 
> so how can i simulate data of pb? 
> 
> in the next future i want also to simulate some bandstructures taking
> spin-orbit splitting into accout as 
> the case for surface states. is that possible with abinit and how?
> 
> thanks for answering!
> 
> bartek
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