[Wien] Parallel LAPW1 Error

[Laurence Marks]

No attachment, so nobody can help.

On Tue, Oct 18, 2016 at 8:51 PM, Paresh Chandra Rout <
pareshchandra at iiserb.ac.in> wrote:

> Dear wien2k users and developers,
>
> I am facing an LAPW1 error while doing single point calculation. While
> initialize my calculation interactively I encounter with small G-max
> warning so  I increased it to higher value. As the lapw1 crashed again and
> again at the very first step so I  initialize the calculation  by
> constructing the case.struct file using GUI but faced the same error. I
> have attached error files and case.struct files below. Any suggestions
> regarding the above mentioned error would be highly appreciated.
>
>
>
> Kind Regards,
> Paresh Chandra Rout
> Graduate student
> Indian Institute of Science Education and Research Bhopal
>



-- 
Professor Laurence Marks
"Research is to see what everybody else has seen, and to think what nobody
else has thought", Albert Szent-Gyorgi
www.numis.northwestern.edu ; Corrosion in 4D: MURI4D.numis.northwestern.edu
Partner of the CFW 100% program for gender equity, www.cfw.org/100-percent
Co-Editor, Acta Cryst A
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