[Wien] Fw: BoltzTraP - case.intrans

[Malgorzata Bukala]

Thank you for your reply.

Best regards,
Margo
----- Original Message ----- 
From: "Laurence Marks" <L-marks at northwestern.edu>
To: "A Mailing list for WIEN2k users" <wien at zeus.theochem.tuwien.ac.at>
Sent: Friday, September 23, 2011 8:09 PM
Subject: Re: [Wien] Fw: BoltzTraP - case.intrans


> Let me expand slightly. A SIGSEV is an error where the code has got
> corrupted and has tried to do something like write in protected
> memory. This is most often because an array is out of bounds.
> Unfortunately just saying that you got a SIGSEV does not help anyone
> -- we cannot diagnose from this. Things to do (stated before):
> a) Check all the input arguments.
> b) Turn on debug options for the code, particularly traceback.
> c) Try and find the line where the code is crashing.
> d) Put a print statement in before where it crashes.
>
> Most often it is a). Sometimes it is something else, but we cannot
> help without you doing some work to narrow it down first. (And I can't
> help since I've never used this particular code.)
>
> On Fri, Sep 23, 2011 at 9:30 AM, Gerhard Fecher <fecher at uni-mainz.de> 
> wrote:
>> wrong k-points (not on YxYxY mesh)
>> or too many k-points
>> or too large lpfac
>> or wrong version of the Intel compiler
>> or wrong compiler options
>> or any other wrong input at some stage
>>
>> Ciao
>> Gerhard
>>
>> ====================================
>> Dr. Gerhard H. Fecher
>> Institut of Inorganic and Analytical Chemistry
>> Johannes Gutenberg - University
>> 55099 Mainz
>> ________________________________________
>> Von: wien-bounces at zeus.theochem.tuwien.ac.at 
>> [wien-bounces at zeus.theochem.tuwien.ac.at]&quot; im Auftrag von 
>> &quot;Malgorzata Bukala [bukala at ifpan.edu.pl]
>> Gesendet: Freitag, 23. September 2011 15:32
>> Bis: wien at zeus.theochem.tuwien.ac.at
>> Betreff: [Wien] Fw: BoltzTraP - case.intrans
>>
>> Dear users of Wien2k,
>>
>> I have not received any answer, so I reiterate my question about one of 
>> the input files of BoltzTraP code , namely case.intrans. According to 
>> user guide of this program, there are to two schemes to obtain DOS: 
>> HISTO/TETRA (histogram/thetrahedron sampling). I want to do my 
>> calculations with TETRA scheme. But when I am trying to run BoltzTraP 
>> code (with TERTA), after some time of working I receive an error message: 
>> SIGSEGV, segmentation fault occurred. What is the reason of this?
>> Margo
>>
>>
>>
>>
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>
>
>
> -- 
> Laurence Marks
> Department of Materials Science and Engineering
> MSE Rm 2036 Cook Hall
> 2220 N Campus Drive
> Northwestern University
> Evanston, IL 60208, USA
> Tel: (847) 491-3996 Fax: (847) 491-7820
> email: L-marks at northwestern dot edu
> Web: www.numis.northwestern.edu
> Research is to see what everybody else has seen, and to think what
> nobody else has thought
> Albert Szent-Gyorgi
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> wirusow 6487 (20110923) __________
>
> Wiadomosc zostala sprawdzona przez program ESET NOD32 Antivirus.
>
> http://www.eset.pl lub http://www.eset.com
>
>
>