Re: [Ifeffit] Fe K-edge second shell problems

2011-08-03 Thread Andrea L Foster
Paul, have you considered explicitly multiple scattering from within the tetrahedron? The short distance you describe for the second shell might be consistent with that. Its pretty easy to write an expression in the fit routine that makes the MS path distances explicitly dependent on the SS

Re: [Ifeffit] Fe K-edge second shell problems

2011-08-03 Thread Scott Calvin
Hi Paul, Looking at your data, I agree that there does seem to be second-shell scattering present in the signal. Unfortunately, that most likely means that your material is not close to one of the obvious model compounds. One possibility to keep in mind is that you may have some kind of