[Wien] I/O-Error in dstart

[Torsten Andersen]

Hello,

did your lstart succeed?

Otherwise, is it a problem just for this case? If not, try to compile 
dstart with -O0.

If it is a problem just for this case, check your *.in* files and your 
struct file.

Best regards,
Torsten Andersen.

Michael Frotscher wrote:
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> Hello, Wien-ML
> 
> when trying to run a rather large and complicated cell (CuB23, rhombohedral 
> crystal cell) I run into the following error:
> 
> Commandline: x dstart -p
> Program input is: ""
> 
> *** FORTRAN I/O ERROR 933: END (OR BEGIN) OF FILE WITH NO "END=" SPECIFIER
>     FILE: cub23.rsp, UNIT: 81
>     LAST FORMAT: (43X,I5)
> ( 0)  0xc0000000002f90b4   __io_ded + 0x464  [/usr/lib/pa20_64//libcl.2]
> ( 1)  0xc0000000002fe5e8   check_read + 0x70  [/usr/lib/pa20_64//libcl.2]
> ( 2)  0xc0000000002feb44   read_to_newline + 0x39c  
> [/usr/lib/pa20_64//libcl.2]
> ( 3)  0xc0000000002ff29c   __read_seq_record + 0x34  
> [/usr/lib/pa20_64//libcl.2]
> ( 4)  0xc0000000002fefd4   __new_record + 0xa4  [/usr/lib/pa20_64//libcl.2]
> ( 5)  0xc0000000002ef980   ____F90_START_IO + 0x8a8  
> [/usr/lib/pa20_64//libcl.2]
> ( 6)  0x4000000000015f04   _start + 0x1e6c  [/home1/fcdv082/wien2k/dstart]
> 111.4u 1.2s 1:53 99%
> 
> Admittedly I have no idea what this could mean and the file dstart.error 
> contains the single, most informative line that there has been an error in 
> dstart...
> Smaller cells (still fooling around with cubic and hexagonal ZnS) are 
> calculated fine.
> 
> Thanks in Advance,
> - -- 
> Michael Frotscher
> Institute of Inorganic and Applied Chemistry
> University of Hamburg, Germany 
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> 
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-- 
Dr. Torsten Andersen                     TA-web: http://deep.at/myspace/
AG Hübner, Department of Physics, Kaiserslautern University, and
Condensed Matter Theory Group, Department of Physics, Uppsala University
Web: http://www.fysik4.fysik.uu.se/         http://www.physik.uni-kl.de/