[Wien] strange time using -it switch

[Peter Blaha]

Are you using $SCRATCH ?

Is this a shared memory machine, do you use ssh or rsh for parallelization ?

execute vec2old_lapw $para on the commandline, eventually add the -x switch
in the first line of the script.

Yongsheng Zhang schrieb:
> Yes, I also notice that. I download the SRC package, and they are no
> difference to my installed one. I definitely have the vec2old_lapw file.
> 
> The funny thing is: In the run_lapw file, the 297th line, it is
>     vec2old_lapw $para >> $dayfile
> With it, no case.vector_old* are written in the case.dayfile.
> However, if I change the line to
>     vec2old_lapw >> $dayfile
> case.vector_old* can be writtern into the case.dayfile, and -it switch
> works fine.
> 
> But I don't know if I did the right thing. Do you think the problem is
> come from the computer system, or k-point parallel?
> 
> Thanks and regards,
> Zhang
> 
> Peter Blaha wrote:
>> I do not see a statement in your dayfile, that the vectors are copied to
>> vector.old (just after lapw0 in the second iteration)
>>
>> Did you update all *_lapw scripts, do you have vec2old_lapw ??
>>
>> Yongsheng Zhang schrieb:
>>   
>>> Dear all,
>>>     
> 
> 

-- 

                                       P.Blaha
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Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-1-58801-15671             FAX: +43-1-58801-15698
Email: blaha at theochem.tuwien.ac.at    WWW: http://info.tuwien.ac.at/theochem/
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