[Pw_forum] where is the instructions for dynmat.x

[Axel Kohlmeyer]

On Mon, 2009-03-16 at 22:51 +0800, vega lew wrote:
> Dear yan,
>  
> I have searched the readme file under the /espresso-4.0.3/example/
> with the keyword 'dynmat.x'. but nothing found. could you please tell
> me which example told us how to calculate IR spectrum?

grep is your friend. check out example09

[akohlmey at vitriol examples]$ grep dynmat example*/run_example
example09/run_example:DYNMAT_COMMAND=" $BIN_DIR/dynmat.x"
example09/run_example:$ECHO "  running dynmat.x as: $DYNMAT_COMMAND"

other than that. if everything else fails, read the source.
i promise that in the case of PH/dynmat.f90 it will be very rewarding.

axel.
>  
> thank you
>  
> vega
> 
> 
> On Mon, Mar 16, 2009 at 8:55 PM, Yan <pemryan at yahoo.cn> wrote:
>         Hello Vega,
>         
>         
>         
>         I suppose you have read the manual. 
>         Besides the files in the folder 'doc', there are some examples
>         in the folder 'examples'. 
>         
>         
>         
>         cheers,
>         
>         
>         
>         Yan 
>         
>         
>         On 2009/3/16 Monday 20:28:22 vega lew wrote:
>         
>         
>         
>         > I found a lot of executive files in /espresso-4.0.3/bin/
>         folder. But I
>         > can't find instructions for some of them, such as dynmat.x.
>         >
>         > by the way, is there any tutorial or example to instruct how
>         to plot IR
>         > spectrum ?
>         
>         
>         
>         
>         
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> 
> 
> -- 
> ==================================================================================
> Vega Lew ( weijia liu)
> PH.D Candidate in Chemical Engineering
> State Key Laboratory of Materials-oriented Chemical Engineering
> College of Chemistry and Chemical Engineering
> Nanjing University of Technology, 210009, Nanjing, Jiangsu, China
> ******************************************************************************************************************
> Email: vegalew at gmail.com
> Office: Room A705, Technical Innovation Building, Xinmofan Road 5#,
> Nanjing, Jiangsu, China  
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-- 
=======================================================================
Axel Kohlmeyer   akohlmey at cmm.chem.upenn.edu   http://www.cmm.upenn.edu
   Center for Molecular Modeling   --   University of Pennsylvania
Department of Chemistry, 231 S.34th Street, Philadelphia, PA 19104-6323
tel: 1-215-898-1582,  fax: 1-215-573-6233,  office-tel: 1-215-898-5425
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If you make something idiot-proof, the universe creates a better idiot.