[Wien] x optic error

soumyajyoti haldar shaldar.mail at gmail.com
Wed Jun 6 17:27:12 CEST 2012


Dear Prof. Blaha and other users,

I am trying to run x optic -p with the new file you provided. I am getting
following error

Commandline: x optic -p
Program input is: ""

^M: Command not found.
foreach: Words not parenthesized.
0.0u 0.0s 0:00.00 0.0% 0+0k 0+0io 0pf+0w
error: command   /home/shaldar/codes/wien2k/opticpara optic.def   failed


Particularly this error comes during the parallel execution of the code.
Serial version does not produce this error.

On Wed, Jun 6, 2012 at 8:56 AM, Peter Blaha <pblaha at theochem.tuwien.ac.at>wrote:

> Here is the modified   opticpara_lapw
>
>
> Am 05.06.2012 19:36, schrieb soumyajyoti haldar:
>
>> Dear Prof. Blaha,
>>
>> How we can get the modified file? Will you update the file after
>> modification in the download section of the site ?
>>
>>
>> On Tue, Jun 5, 2012 at 3:56 PM, Peter Blaha <pblaha at theochem.tuwien.ac.at<mailto:
>> pblaha at theochem.**tuwien.ac.at <pblaha at theochem.tuwien.ac.at>>> wrote:
>>
>>    You are absolutely right. $SCRATCH is not used consistently in x_lapw
>> and opticpara
>>
>>    I'll add ${scratch} in front of all $case.symmat_$i$updn lines (and
>> similar for other files)
>>    in opticpara_lapw.
>>
>
> --
>
>                                      P.Blaha
> ------------------------------**------------------------------**
> --------------
> Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
> Phone: +43-1-58801-165300             FAX: +43-1-58801-165982
> Email: blaha at theochem.tuwien.ac.at    WWW: http://info.tuwien.ac.at/**
> theochem/ <http://info.tuwien.ac.at/theochem/>
> ------------------------------**------------------------------**
> --------------
>
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-- 
Soumyajyoti Haldar, PhD Student

Department of Physics and Astronomy, Materials Theory
Ångström Laboratory, Office Å13235 | Uppsala University
Box 516, SE-75120, Uppsala, SWEDEN

Phone: (+46) 18 471 5860
Mobile: (+46) 070 0399 394
http://www.physics.uu.se/en/page/soumyajyoti-haldar
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