[Wien] case.vector and case.output1 in k-parallel

nluo@uiuc.edu nluo at uiuc.edu
Wed May 21 08:12:16 CEST 2008


Peter, thanks for reply. Actually I need it to speed up xcrysden on Fermi surface. 
Cheers, 


---- Original message ----
>Date: Wed, 21 May 2008 07:21:44 +0200
>From: Peter Blaha <pblaha at theochem.tuwien.ac.at>  
>Subject: Re: [Wien] case.vector and case.output1 in k-parallel  
>To: A Mailing list for WIEN2k users <wien at zeus.theochem.tuwien.ac.at>
>
>No.
>
>But for what purpose would you need that ?
>
>All programs which use vectors or output1 files have a -p option too and 
>can handle the splitted files.
>
>nluo at uiuc.edu schrieb:
>> Dear all, 
>> I noticed that files case.vector and case.output1 are not generated in x lapw1 -p, at least for Wien2k06. Is there a simple option in x lapw1 -p or some other utilities that can combine the case.vector_n (case.output1_n) files into the single case.vector (case.output1) file? 
>> Thanks in advance, 
>> 
>>  
>> 
>> Nie Luo
>> 
>> Research Assistant Professor
>> Department of Nuclear, Plasma and Radiological Engineering
>> University of Illinois at Urbana-Champaign
>> & Senior Scientist
>> NPL Associates, Inc
>> 
>> 103 S Goodwin
>> Urbana, IL 61801
>> _______________________________________________
>> Wien mailing list
>> Wien at zeus.theochem.tuwien.ac.at
>> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
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Nie Luo

Research Assistant Professor
Department of Nuclear, Plasma and Radiological Engineering
University of Illinois at Urbana-Champaign
& Senior Scientist
NPL Associates, Inc

103 S Goodwin
Urbana, IL 61801


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