[Wien] DSTART error

[Laurence Marks]

Without more information it is unlikely that anyone can help. How many
k-pts, what RKMAX, did you check error files for lapw1, is it the struct
you sent earlier?

---
Professor Laurence Marks
Department of Materials Science and Engineering
Northwestern University
http://www.numis.northwestern.edu
Corrosion in 4D http://MURI4D.numis.northwestern.edu
Co-Editor, Acta Cryst A
"Research is to see what everybody else has seen, and to think what nobody
else has thought"
Albert Szent-Gyorgi
On Nov 24, 2015 21:36, "Rajneesh Chaurasiya" <rajnano2012 at gmail.com> wrote:

> i have completed the init_lapw successfully but when i run_lapw then the
> following error come in to existence.  which i have shown through the
> attached file.
> so please help me what are the problem in my calculation
>
> On Tue, Nov 24, 2015 at 2:40 PM, Rajneesh Chaurasiya <
> rajnano2012 at gmail.com> wrote:
>
>>
>> Dear Sir,
>>
>> currently i have started to work on the double perovskite material. so
>> during initialization i faces some problem with dstart error whose
>> case.struct file has been attached with this mail so please help me to
>> solve this problem.
>>
>>
>
>
> --
> Thanks & Regards
> Rajneesh Chaurasiya
> Junior Research Fellow
> ABV-IIITM, Gwalior, India
> Mob. No. +91-9584499697
>               +91-8435727031
>
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