[Wien] dstart

Leonardo Pisani pisani at itp.uni-frankfurt.de
Thu Jun 9 18:56:54 CEST 2005


Dear wien users,

I am running dstart for a 24 atom unit cell (all inequivalent),
space group 6 (P m).
The error message is

PGFIO-F-217/formatted read/unit=81/attempt to read past end of file.
 File name = TiOCl_LT_U.rsp    formatted, sequential access   record = 5748
 In source file dstart.f, at line number 238

The .rsp file looks regular.

Is there any limitation/constraint in WIEN2k
concerning the space group 6 (P m)?

Any suggestion is highly appreciated.

Best Regards,
Leonardo Pisani.

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Leonardo Pisani
Institut fuer Theoretische Physik
J.W.Goethe-Universitat Frankfurt
Max von Laue Strasse 1
60438 Frankfurt am Main
Germany

Phone: +49 (69) 798-47828
Fax:   +49 (69) 798-47832
E-mail: pisani at itp.uni-frankfurt.de
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