Dear Frank

With regard to accurately determining the size of small particles or 
nano-crystallites, have you seen this article on "Pitfalls in the 
characterization of nanoporous and nanosized materials" by Claudia Weidenthaler?

https://pubs.rsc.org/en/content/articlelanding/2011/nr/c0nr00561d

Best regards,

Darren

> -----Original Message-----
> From: [email protected]
> Sent: Thu, 6 Jun 2019 12:39:29 +0200
> To: [email protected]
> Subject: Literature on Rietveld limitations in nano materials
> 
> Dear fellow Rietvelders,
> 
> Could anyone point me to some nice literature which critically discusses
> the limitations of the Rietveld method when it comes to nano-crystalline
> materials (specifically in the 1 to 3 nm range)?
> As far as I'm aware, the core Rietveld literature seems to touch this
> point only in the passing.
> 
> Background:
> To the best of my knowledge, Rietveld-derived parameters (like lattice
> constants or domain sizes) should not be trusted as being "physically
> meaningful"  anymore when you fit the powder pattern of a material in
> the few nm range with standard Rietveld tools.
> My naive understanding of this problem is that the physical principles
> of diffraction (or rather the best way to model it) gradually change
> when you go from long-range ordered to medium-/short-range ordered
> materials.
> Being a Rietveld practitioner rather than a theoretician, and having no
> first-hand experience with WPPM and PDF methods, I am often confronted
> with the problem to explain to my "customers" why I can't extract
> trustworthy lattice constants or domain sizes from their
> nano-crystalline samples, especially if it seems technically possible to
> fit the pattern with a Rietveld program.
> I think it would be nice if I could cite some critical discussion, or
> overview article with further references, to put my finger on the
> problem.
> Especially in the catalysis community literature, my impression is that
> the applicability of the Rietveld method is sometimes overestimated,
> leading to overinterpretation of the results.
> 
> Any suggestions?
> 
> Best wishes,
> Frank Girgsdies
> 
> 
> 
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