[Ifeffit] Principal Component Analysis (PCA) for XANES

Teck Kwang Choo teck.kwang.choo at monash.edu
Wed Jul 2 00:59:25 CDT 2014


Hi Everyone,

Does anyone know what software I should use to perform a Principal
Component Analysis (PCA) on my K-edge XANES spectra (for sulfur)? The
reason I need to use this technique is because I have a couple of reference
compound spectra but am not sure which of those I should use to fit my
unknown sample spectrum.

Any help is appreciated.

Thanks and kind regards.


Teck Kwang Choo
PhD Candidate
Department of Chemical Engineering
Room 225, Building 36
Monash University
Mobile No.: 04-11489904
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