[Wien] Problem in calculating optical conductivity

Gavin Abo gsabo at crimson.ua.edu
Sat Feb 23 16:52:07 CET 2013


You could try:

$ export _POSIX2_VERSION=199209
$ x optic -so -up -p

as described in the post:

http://zeus.theochem.tuwien.ac.at/pipermail/wien/2008-August/011287.html

On 2/23/2013 12:48 AM, Santu Baidya wrote:
> Dear Wien2k users,
>     I am doing calculation of optical properties for a perovskite 
> compound using Wien2k version 07.3 (Release 13/8/2007) .
>
> After successfully run the
>
> runsp_lapw -so -p lapw1 -e lcore
> and  editing case.inop file
> I ran the
>      x optic -so -up -p
>
> But i got the following error:
>
> [7]  + Done                          ( $remote $machine[$p]  ...
> [10] + Done                          ( $remote $machine[$p]  ...
>    Summary of opticpara:
>    node41.local     user=0     wallclock=0
>    node39.local     user=0     wallclock=0
>    node35.local     user=0     wallclock=0
>    node34.local     user=0     wallclock=0
> tail: cannot open `+2' for reading: No such file or directory
> tail: cannot open `+2' for reading: No such file or directory
> tail: cannot open `+2' for reading: No such file or directory
> tail: cannot open `+2' for reading: No such file or directory
> tail: cannot open `+2' for reading: No such file or directory
>
> I have also verified if the error is system dependent or not by doing 
> calculation on other systems, but I got the same error.
>
> Could anyone please tell me about the problem.
>
>
> Thanks in advance.
>
>
> Santu Baidya
> SRF, CMPMS,
> SNBNCBS,
> Kolkata-700098
>
> -- 
> *"The happiest people do not always have the best of all,* * they 
> simply appreciate  what they find on their way!!!" SANTU
> *
>
>

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