[Wien] I/O-Error in dstart

Michael Frotscher frotscher at chemie.uni-hamburg.de
Fri Sep 19 16:23:52 CEST 2003


-----BEGIN PGP SIGNED MESSAGE-----
Hash: SHA1

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 
-----BEGIN PGP SIGNATURE-----
Version: GnuPG v1.2.2-rc1-SuSE (GNU/Linux)

iD8DBQE/axF4/f+kgY+d9bQRAsBqAKDnRrAEySsZK//Tx/ZncNTCtzuwOACg2HMW
fKbTx7CvAPhdRrv6Du8lu2E=
=+Xq5
-----END PGP SIGNATURE-----





More information about the Wien mailing list