[Pw_forum] Segmentation fault on relaxed structure in vc-relax on QE4.3.1

[Gabriele Sclauzero]

I think you should file a bug report here

http://qe-forge.org/tracker/?func=add&group_id=10&atid=133

HTH

GS

Il giorno 29/lug/2011, alle ore 12.51, Marino Vetuschi Zuccolini ha scritto:

> Paolo,
> the problem is still there. How can I report the bug on qe-forge. I've already an account.
> 
> Thank you 
> 
> m.
> 
> On 28 Jul 2011, at 18:14, Marino Vetuschi Zuccolini wrote:
> 
>> I've compiled the 4.3.2 version of QE and the bug it is not present apparently on some tests I did.
>> I will follow your suggestion if it will still present.
>> 
>> Thank you very much.
>> 
>> m.
>> On 28 Jul 2011, at 17:38, Paolo Giannozzi wrote:
>> 
>>> 
>>> On Jul 26, 2011, at 13:50 , Marino Vetuschi Zuccolini wrote:
>>> 
>>>> during the computation of the last SCF cycle *on relaxed structure*
>>>> this segmentation fault error (repeated for each process) happens
>>> 
>>> a problem in the last step of a variable-cell optimization was fixed
>>> in v.4.3.2. Please file a bug report on qe-forge if still present.
>>> 
>>> P.
>>> ---
>>> Paolo Giannozzi, Dept of Chemistry&Physics&Environment,
>>> Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
>>> Phone +39-0432-558216, fax +39-0432-558222
>>> 
>>> 
>>> 
>>> 
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>> 
>> 
>> 
>> *******************************************************
>> Marino Vetuschi Zuccolini
>> zucco at dipteris.unige.it
>> Researcher / Geochemist
>> Laboratory of Geochemistry
>> 
>> DIPartimento per lo studio della TErra e delle sue RISorse - Università  di Genova
>> Tel. ++39 010 3538136 Fax. ++39 010 352169
>> Corso Europa 26, 16132 - Genova - Italy
>> 
>> 
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> 
> 
> 
> *******************************************************
> Marino Vetuschi Zuccolini
> zucco at dipteris.unige.it
> Researcher / Geochemist
> Laboratory of Geochemistry
> 
> DIPartimento per lo studio della TErra e delle sue RISorse - Università  di Genova
> Tel. ++39 010 3538136 Fax. ++39 010 352169
> Corso Europa 26, 16132 - Genova - Italy
> 
> 
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://www.democritos.it/mailman/listinfo/pw_forum


§ Gabriele Sclauzero, EPFL SB ITP CSEA
   PH H2 462, Station 3, CH-1015 Lausanne







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