[Wien] Fwd: problem with display of SCF results with Wi2ek version 8

Muhammad Sajjad sajjadpu at gmail.com
Tue Aug 28 08:16:07 CEST 2012


Thank you prof.
could you let me know the solution to this problem? i have checked
mailing list but unfortunately i can not solve it.

On 8/27/12, Peter Blaha <pblaha at theochem.tuwien.ac.at> wrote:
> Some graphics options of old versions of WIEN2k are not compatible with new
> gnuplot versions.
>
> There were several posts on the mailing list describing these problems.
>
> Am 27.08.2012 06:03, schrieb Muhammad Sajjad:
>> Respected Group Members
>> I am running wien version 8 on a machine of type Dell Core I5 Desktop
>> with operating system FEDORA17 (64 BIT) , fortran compiler
>> "intel_fortran_composer_xe_2011_lin". The purpose of my calculations
>> is to get quantity ELECTRON DENSITY (ED) and DOS. I have completed SCF
>> but when i try to get ED & DOS then the plots do not appear.what does
>> happen there, i have attached it herewith the mail. please see the
>> attachment. even though i have installed gnuplot with command yum
>> install gnuplot.
>> Also when i run SCF with 11 version then it works but i want to use 8
>> version as i have some problems with version 11.  Please help me in
>> this regard. In advance, thanks a lot.
>>
>> Kind Regards
>> M. Sajjad
>>
>>
>>
>> _______________________________________________
>> Wien mailing list
>> Wien at zeus.theochem.tuwien.ac.at
>> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
>>
>
> --
> -----------------------------------------
> Peter Blaha
> Inst. Materials Chemistry, TU Vienna
> Getreidemarkt 9, A-1060 Vienna, Austria
> Tel: +43-1-5880115671
> Fax: +43-1-5880115698
> email: pblaha at theochem.tuwien.ac.at
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