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Re: [abinit-forum] it is vital to get your help! Please read it soon, please!


Chronological Thread 
  • From: Martin Häufel <martin.haeufel@googlemail.com>
  • To: forum@abinit.org
  • Subject: Re: [abinit-forum] it is vital to get your help! Please read it soon, please!
  • Date: Fri, 05 Feb 2010 17:46:40 +0100
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Dear Zahra,

I agree with Matteo Giantomassi and Tonatiuh. Try nsppol 2 and gwpara 2 in tgw2_2.in .

Do you still have problems? Could you post the error message in the log file? I got it running on my machine.

Best regards,

Martin Haeufel
TU Munich, WSI (T33)
www.wsi.tum.de

On 05.02.2010 12:59, Tonatiuh Rangel wrote:
Dear Zahra,

After talking to Matteo Giantomassi, who is more involved in the
development of this part of the code, we come to some suggestions.


To create the kss file, you should use
kssform 3

For the screening calculation:
nsppol 2
gwpara 2
awtr 1


gwpara 2, means parallelization over bands,
this is more standard for GW calculations.

THis should work.
Best
Tonatiuh



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