[Wien] run init_phonon_lapw error

Peter Blaha pblaha at theochem.tuwien.ac.at
Mon Mar 20 09:45:49 CET 2006


My guess would be that you made an error when transfering the file from
Windows to Linux. Such filetransfer must be in ASCII mode, so that the
file is converted from Windows to Linux style!
(There is also a dos2unix utility)

> Dear wiener:
>      I want to do some phonon calculations with PHONON program.And I met some problems.
>      I tried to do the example 'Mo.d45' in the SRC_phonon directory.I transfered the 'Mo.d45' to unix format.When I used init_phonon_lapw to create case_xx.struct there came some problems.The messages are followed:
>   
>  Program generates  WIEN struct files from phonon file.
>  
>  Filename of phonon file: 
>  
>  Fatal Error occured:
>  Error reading  file:   Mo.d45                                                     
>  
>  Program terminated.
>  
> c: Subscript out of range.
> 
>  What should I do to correct this problem?
>  Thanks for your help.
>  Best regards.
>                                                                Yu Xie
> _______________________________________________
> Wien mailing list
> Wien at zeus.theochem.tuwien.ac.at
> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
> 


                                      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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