[Wien] composite x-ray spectrum.

shokoufe khosravi shokoufe_khosravi at yahoo.com
Sun Jul 18 13:49:45 CEST 2004


Thank you Dr. Kevin for your helpful answer.
I think that if I want to add spectra of several atoms
I must weight each of them with some additional
parameters , if yes ,can any one tell me what is
parameters that I must consider?
Thanks in advance.
Regards.

Jorissen Kevin <Kevin.Jorissen at ua.ac.be> wrote:
> The xspec program calculates just one edge, so you
> have to calculate all edges separately and sum the
> results afterwards.
>  
> Maybe you can use the scripts I posted on the ML
> some time ago to calculate spectra for all atoms in
> the unit cell and add them (you'll have to change 'x
> elnes' to 'x spec' and case.innes to case.inxs).
> If these are not sophisticated enough, you can
> always write your own program or shell script or
> improve on my scripts.
>  
> Good luck,
>  
> Kevin.
>  
> PS I'll be away for a few weeks, so I will not be
> able to give you any help concerning the scripts for
> some time.  They're pretty simple, though.
>  
> 
>  -----Oorspronkelijk bericht----- 
>  Van: shokoufe khosravi
> [mailto:shokoufe_khosravi at yahoo.com] 
>  Verzonden: za 7/17/2004 2:42 
>  Aan: wien at zeus.theochem.tuwien.ac.at 
>  CC: 
>  Onderwerp: [Wien] composite x-ray spectrum.
>  
>  
> 
>  Dear all.
>  I want to work about x-ray spectrum . I can plot
>  several atomic spectra but I don't know how to plot
>  composite spectrum from two atoms or total spectrum
> of
>  the sample (containing impurity).
>  Any comment appreciated.
>  Best regards.
>  
>  
>                 
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