[Wien] Error in dstart

Gavin Abo gsabo at crimson.ua.edu
Mon Jun 2 03:28:34 CEST 2014


That can happen if you did not run "x lstart" or there can be an earlier 
problem (typically, from an improper case.inst or case.struct) such that 
the running of "x lstart" is unsuccessful 
[http://www.mail-archive.com/wien%40zeus.theochem.tuwien.ac.at/msg07603.html].

On 6/1/2014 6:54 PM, Farshad Nejadsattari wrote:
> Dear Developers and users,
>
>    I am working on a monoclinic structure with space group C2/m (12), 
> although this space group is not supported in the structgen on w2web 
> interface I managed to convert it properly by hand and started the 
> initialization though in the 18th phase of the initialization I ended 
> up with this error:
>
>
>
> forrtl: severe (24): end-of-file during read, unit 81, file 
> /home/hpc2768/Examples/Al13Fe4/Al13Fe4.rsp
> Image              PC                Routine  Line        Source
> dstart             00000000004B912A  Unknown Unknown  Unknown
> dstart             00000000004B7C26  Unknown Unknown  Unknown
> dstart             0000000000476630  Unknown Unknown  Unknown
> dstart             0000000000440C5E  Unknown Unknown  Unknown
> dstart             000000000044019F  Unknown Unknown  Unknown
> dstart             0000000000452D46  Unknown Unknown  Unknown
> dstart             000000000040F6F1  init_     132  init.F
> dstart             000000000040E709  MAIN__     15  dstart.F
> dstart             0000000000403BFC  Unknown Unknown  Unknown
> libc.so.6          000000395FA1ED1D  Unknown Unknown  Unknown
> dstart             0000000000403B09  Unknown Unknown  Unknown
> 0.002u 0.013s 0:00.03 33.3%0+0k 8+24io 0pf+0w
> error: command   /u1/work/hpcg1444/WIEN2K/test-build/dstart dstart.def 
>   failed
>
>
>
> I would like to know where this error is originating from and your 
> assistance in resolving this problem is truly appreciated, I will add 
> my case.struct file if more information is necessary.
>
> with regards,
>
> Farshad Nejadsattari
>
> PhD Candidate in Condensed matter Physics

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