[Ifeffit] multiple absorber atoms
Jesús Eduardo Vega Castillo
jevecas at gmail.com
Tue Oct 21 02:52:46 CDT 2014
Thank you very much!
2014-10-20 17:14 GMT+02:00 Bruce Ravel <bravel at bnl.gov>:
> On 10/20/2014 10:27 AM, Scott Calvin wrote:
>> Hi Jesus,
>> Just make a path list for each crystallographic site, and then weight S02
>> for the paths by the fraction of absorbing atoms in the associated site.
> This slide (and the surrounding pages) from one of my EXAFS Education
> talks elaborates on Scott's answer and may be helpful to you.
> --Scott Calvin
>> Sarah Lawrence College
>> On Oct 20, 2014, at 10:00 AM, Jesús Eduardo Vega Castillo <
>> jevecas at gmail.com> wrote:
>>> This is my first message to the list so I expect to do it right.
>>> I need to generate a path list for EXAFS fitting within ifeffit, based
>>> on a crystalline structure that has two different crystallographic
>>> positions for the absorber atom (edge K of Mo). Is there any way to do this?
>>> I would appreciate any information you could give me.
>>> Thanks in advance
>>> Ifeffit mailing list
>>> Ifeffit at millenia.cars.aps.anl.gov
>> Ifeffit mailing list
>> Ifeffit at millenia.cars.aps.anl.gov
> Bruce Ravel ------------------------------------ bravel at bnl.gov
> National Institute of Standards and Technology
> Synchrotron Science Group at NSLS-II
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