[Ifeffit] lanthanides convergence

[Eugenio Otal]

Bruce,
I am running feff to model XANES of Erbium doped ZnO. I have a big problem
to find the convergence of FMS in this kind of systems. I increased the
atoms number in feff code to nclusx=500 and still have not found
convergence.
Should I increase the nclusx to a bigger number?, is there a limit for this
number independent from the computer RAM or I do have another chance?.
Thanks for your time and patience.




8<- - - - - - 8<- - - - - - 8<- - - - - - 8<- - - - - -

Eugenio H. Otal
CINSO - CONICET - CITEFA
eotal at citefa.gov.ar
eugenioh at gmail.com

8<- - - - - - 8<- - - - - - 8<- - - - - - 8<- - - - - -
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