[Ifeffit] Ifeffit Digest, Vol 166, Issue 12

Bruce Ravel bravel at bnl.gov
Fri Dec 16 12:14:55 CST 2016

On 12/16/2016 12:55 PM, Raj kumar wrote:
> Thanks for the explanation. Yes, both files are generating the same kind
> of output but the positioning of atoms can mislead in the context of
> structure. That's why i have raised the question.

Hi Raj,

But they are /the/ /same/ structure, so they give the same XAFS results, 
which is the problem that all the versions of Atoms intend to solve. 
Again, I don't think there is anything wrong that needs my attention.


  Bruce Ravel  ------------------------------------ bravel at bnl.gov

  National Institute of Standards and Technology
  Synchrotron Science Group at NSLS-II
  Building 743, Room 114
  Upton NY, 11973

  Homepage:    http://bruceravel.github.io/home/
  Software:    https://github.com/bruceravel
  Demeter:     http://bruceravel.github.io/demeter/

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