[xcrysden] Fwd: Crash on vc-relax output

[Marino Vetuschi Zuccolini]

>
> Ciao Tone,
>
> this is one of the output that stop xcrysden with the message as in  
> the previous email. I use xcrysden 1.4.1.bin on macosx.
> I hope this helps.
>
> Marino
>
>
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>
>
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> On 13/ott/08, at 19:53, Tone Kokalj wrote:
>
>> On Mon, 2008-10-13 at 18:02 +0200, Marino Vetuschi Zuccolini wrote:
>>> Dear Tone,
>>> here enclosed you can find an error following an attempt of download
>>> of a pwscf output (optimized coordinates, vc-relax on supercell).  
>>> Does
>>> you can understand how it is possible to see the structure? I think
>>> this error is related to the fact that it is a super cell. Is it?
>>
>> No, supercell does not matter at all. xcrysden is "stupid" and does  
>> not
>> know about supercells, it considers anything as a unit cell ...
>>
>> Please post your pwscf output file, only then I may help.
>>
>> Regards, Tone
>> -- 
>> Tone Kokalj <tone.kokalj at ijs.si>
>> J. Stefan Institute, Jamova 39, 1000 Ljubljana, Slovenia (tel:
>> +386-1-477-3523 // fax:+386-1-477-3822)
>>
>> _______________________________________________
>> XCrySDen mailing list
>> XCrySDen at democritos.it
>> http://www.democritos.it/mailman/listinfo/xcrysden
>
>
>
> *******************************************************
> Marino Vetuschi Zuccolini
> zucco at dipteris.unige.it
> Researcher / Geochemist
> Laboratory of Geochemistry
>
> DIPartimento per lo studio della TErra e delle sue RISorse -  
> Universit?  di Genova
> Tel. ++39 010 3538136 Fax. ++39 010 352169
> Corso Europa 26, 16132 - Genova - Italy
>
>



*******************************************************
Marino Vetuschi Zuccolini
zucco at dipteris.unige.it
Researcher / Geochemist
Laboratory of Geochemistry

DIPartimento per lo studio della TErra e delle sue RISorse -  
Universit?  di Genova
Tel. ++39 010 3538136 Fax. ++39 010 352169
Corso Europa 26, 16132 - Genova - Italy