[Ifeffit] Making N (coordination number) a variable.

Anatoly Frenkel anatoly.frenkel at stonybrook.edu
Wed Aug 1 10:15:29 CDT 2018


Make it 1 in the N window and make amp*N expression in the S02 window
instead. Then use N as a coordination number (fix or vary it).
Anatoly

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Anatoly I. Frenkel
Professor
Department of Materials Science and Chemical Engineering
Stony Brook University
Stony Brook, NY 11794, Ph: 631-632-2751
Email:  anatoly.frenkel at stonybrook.edu
<https://mail.bnl.gov/OWA/redir.aspx?C=F6wCGt4adziN6IvpdRQ-rWdgy3Oaoif_x-0ybKTBGBlALcrWeszTCA..&URL=mailto%3ajgchen%40columbia.edu>
http://you.stonybrook.edu/frenkel

Joint Appointment:
Chemistry Department, Brookhaven National Laboratory
Upton, NY 11973. Ph: 631-344-3013. Group: 631-344-3494
Email: frenkel at bnl.gov
https://www.bnl.gov/chemistry/bio/FrenkelAnatoly.asp
Spokesperson, Synchrotron Catalysis Consortium (SCC) at BNL
http://you.stonybrook.edu/scc2
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On Wed, Aug 1, 2018 at 11:07 AM, M Solo <sarsol89 at gmail.com> wrote:

> Hello
> Is there a way in artemis to make N, coordination number, a variable to be
> used in GDS window? I do realize that N and ss are closely linked and do
> very similar things in the fit, but it seems i may need fractional
> (average) coordination number for one of the paths, and am fine fixing ss
> to see where N levels off.
>
> Thank you very much.
>
> Alex Solov
>
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