[Pw_forum] About midpoint.x

[Andrea Ferretti]

prefix looks correct,
but work_dir must be

work_dir='/home/sdwang/WanT/tmp/test11'

what is inside the directories .export or .save written by espresso is 
managed internally. The user should just point out the position of the 
above dirs.

Andrea

>  
>  *** from PE    :     0
>  *** in routine : io_init
>  *** error msg. : invalid dftdata_fmt =
>  *** error code :     1
>  *** aborting ***
>
> My input file is :
> &INPUT
>    prefix  = 'pt_h2_pt',
>    work_dir = '/home/sdwang/WanT/tmp/test11/pt_h2_pt.export/index.xml',      
>    output_fmt  =  "crystal"   
>    rcut  =  5.0        
>    toll  =  0.10        
> /
> What is my problem?
> 
>

-- 
Andrea Ferretti
Oxford University, Department of Materials
Parks Road, Oxford OX1 3PH, UK
Tel: +44 (0)1865 612796;  Skype: andrea_ferretti
URL: http://quasiamore.mit.edu

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